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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (4) Show 4 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2006-08-12 23:08:41 UTC

Update Date

2021-09-16 15:27:27 UTC

HMDB ID

HMDB0003529

Secondary Accession Numbers

HMDB0006232
HMDB03529
HMDB06232

Metabolite Identification

Common Name

myo-Inositol 1,3,4,5,6-pentakisphosphate

Description

myo-Inositol 1,3,4,5,6-pentakisphosphate, also known as Ins(1,3,4,5,6)P5 or inositol pentaphosphate, is an inositol polyphosphate of emerging significance in cellular signalling. Both Ins(1,3,4,5,6)P5 and its C-2 epimer scyllo-inositol pentakisphosphate (scyllo-InsP(5)) were synthesized from the same myo-inositol-based precursor (PMID: 16755629 ). InsP6, Ins(1,3,4,5,6)P5, and their close metabolic relatives are amongst the more abundant intracellular inositol polyphosphates. They are involved in chromatin organization, DNA maintenance, gene transcription, nuclear mRNA transport, membrane trafficking, and control of cell proliferation (PMID: 14992690 ).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI


  Mrv1652309042000292D          

 38 38  0  0  0  0            999 V2000
    1.4289    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164    3.1895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414    1.7605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5395    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164   -2.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414   -0.9355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0164    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8414   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.8250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.4125    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.4125    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  1  0  0  0  0
  1  7  1  6  0  0  0
  2 23  1  6  0  0  0
  3 24  1  6  0  0  0
  4 25  1  6  0  0  0
  5 26  1  1  0  0  0
  6 27  1  6  0  0  0
 28  8  1  0  0  0  0
 28  9  1  0  0  0  0
 28 10  2  0  0  0  0
 28 23  1  0  0  0  0
 29 11  1  0  0  0  0
 29 12  1  0  0  0  0
 29 13  2  0  0  0  0
 29 24  1  0  0  0  0
 30 14  1  0  0  0  0
 30 15  1  0  0  0  0
 30 16  2  0  0  0  0
 30 25  1  0  0  0  0
 31 17  1  0  0  0  0
 31 18  1  0  0  0  0
 31 19  2  0  0  0  0
 31 26  1  0  0  0  0
 32 20  1  0  0  0  0
 32 21  1  0  0  0  0
 32 22  2  0  0  0  0
 32 27  1  0  0  0  0
  1 33  1  1  0  0  0
  2 34  1  1  0  0  0
  3 35  1  1  0  0  0
  4 36  1  6  0  0  0
  5 37  1  6  0  0  0
  6 38  1  1  0  0  0
M  END

HMDB0003529
     RDKit          3D
myo-Inositol 1,3,4,5,6-pentakisphosphate
 49 49  0  0  0  0  0  0  0  0999 V2000
   -4.1732    0.8681   -0.6397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1076    1.8943   -0.3999 P   0  0  0  0  0  5  0  0  0  0  0  0
   -3.6075    2.8397    0.9241 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0459    2.9095   -1.7421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6184    1.2299   -0.0158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1988    0.2516   -0.8861 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0596    0.7674   -1.5776 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2000    1.9086   -2.3216 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    1.1652   -0.4645 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4217    1.9995    0.4634 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234    3.4980    0.5504 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.1917    3.4285    1.7309 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1308    4.7640    0.8064 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    3.7938   -0.8613 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4854   -0.1473    0.1565 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0034   -0.8659   -0.9225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6367   -1.1920   -0.7754 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.2158   -0.7232    0.5304 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8470   -2.8703   -0.9125 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5094   -0.4761   -2.0355 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3345   -0.9389    0.7147 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1084   -0.4202    1.9468 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0375   -1.4937    3.2053 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.7464   -2.7798    2.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5118   -1.9792    3.7206 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8421   -0.8926    4.5372 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472   -1.0366   -0.1818 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5612   -2.0101   -1.1414 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6361   -3.2983   -1.0921 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.8673   -4.5969   -1.1928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6711   -3.2275   -2.4353 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5258   -3.3436    0.3443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4914    3.2291    0.6591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9707    2.3828   -2.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9332    0.0767   -1.6979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5298   -0.0328   -2.1644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1038    1.7676   -3.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8596    1.7110   -0.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1556    4.6916    1.7628 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625    4.3887   -0.5933 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2564    0.0651    0.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0417   -3.1409   -1.8574 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1290    0.2212   -1.7124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6727   -1.9710    0.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4131   -2.7321    4.3762 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9569   -1.6313    5.1830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7383   -1.3181    0.4241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2994   -3.9657   -2.4649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3233   -2.7678    0.2185 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
  9 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 17 20  1  0
 15 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 23 26  1  0
 21 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 29 32  1  0
 27  6  1  0
  3 33  1  0
  4 34  1  0
  6 35  1  6
  7 36  1  6
  8 37  1  0
  9 38  1  6
 13 39  1  0
 14 40  1  0
 15 41  1  1
 19 42  1  0
 20 43  1  0
 21 44  1  1
 25 45  1  0
 26 46  1  0
 27 47  1  1
 31 48  1  0
 32 49  1  0
M  END


  Mrv1652309042000292D          

 38 38  0  0  0  0            999 V2000
    1.4289    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164    3.1895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414    1.7605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5395    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164   -2.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414   -0.9355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0164    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8414   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.8250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.4125    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.4125    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  1  0  0  0  0
  1  7  1  6  0  0  0
  2 23  1  6  0  0  0
  3 24  1  6  0  0  0
  4 25  1  6  0  0  0
  5 26  1  1  0  0  0
  6 27  1  6  0  0  0
 28  8  1  0  0  0  0
 28  9  1  0  0  0  0
 28 10  2  0  0  0  0
 28 23  1  0  0  0  0
 29 11  1  0  0  0  0
 29 12  1  0  0  0  0
 29 13  2  0  0  0  0
 29 24  1  0  0  0  0
 30 14  1  0  0  0  0
 30 15  1  0  0  0  0
 30 16  2  0  0  0  0
 30 25  1  0  0  0  0
 31 17  1  0  0  0  0
 31 18  1  0  0  0  0
 31 19  2  0  0  0  0
 31 26  1  0  0  0  0
 32 20  1  0  0  0  0
 32 21  1  0  0  0  0
 32 22  2  0  0  0  0
 32 27  1  0  0  0  0
  1 33  1  1  0  0  0
  2 34  1  1  0  0  0
  3 35  1  1  0  0  0
  4 36  1  6  0  0  0
  5 37  1  6  0  0  0
  6 38  1  1  0  0  0
M  END
> <DATABASE_ID>
HMDB0003529

> <DATABASE_NAME>
hmdb

> <SMILES>
[H][C@@]1(O)[C@]([H])(OP(O)(O)=O)[C@@]([H])(OP(O)(O)=O)[C@]([H])(OP(O)(O)=O)[C@@]([H])(OP(O)(O)=O)[C@]1([H])OP(O)(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2+,3-,4-,5+,6+

> <INCHI_KEY>
CTPQAXVNYGZUAJ-KXXVROSKSA-N

> <FORMULA>
C6H17O21P5

> <MOLECULAR_WEIGHT>
580.0554

> <EXACT_MASS>
579.895040166

> <JCHEM_ACCEPTOR_COUNT>
16

> <JCHEM_ATOM_COUNT>
49

> <JCHEM_AVERAGE_POLARIZABILITY>
38.4765181248954

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
11

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(1R,2S,3r,4R,5S,6r)-3-hydroxy-2,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid

> <ALOGPS_LOGP>
-0.14

> <JCHEM_LOGP>
-4.399839808666667

> <ALOGPS_LOGS>
-1.64

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-10

> <JCHEM_PKA>
0.6363247192687775

> <JCHEM_PKA_STRONGEST_ACIDIC>
0.1881270613850381

> <JCHEM_POLAR_SURFACE_AREA>
354.0299999999999

> <JCHEM_REFRACTIVITY>
90.13949999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
10

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.34e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[(1R,2S,3r,4R,5S,6r)-3-hydroxy-2,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0003529
     RDKit          3D
myo-Inositol 1,3,4,5,6-pentakisphosphate
 49 49  0  0  0  0  0  0  0  0999 V2000
   -4.1732    0.8681   -0.6397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1076    1.8943   -0.3999 P   0  0  0  0  0  5  0  0  0  0  0  0
   -3.6075    2.8397    0.9241 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0459    2.9095   -1.7421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6184    1.2299   -0.0158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1988    0.2516   -0.8861 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0596    0.7674   -1.5776 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2000    1.9086   -2.3216 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    1.1652   -0.4645 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4217    1.9995    0.4634 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234    3.4980    0.5504 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.1917    3.4285    1.7309 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1308    4.7640    0.8064 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    3.7938   -0.8613 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4854   -0.1473    0.1565 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0034   -0.8659   -0.9225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6367   -1.1920   -0.7754 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.2158   -0.7232    0.5304 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8470   -2.8703   -0.9125 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5094   -0.4761   -2.0355 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3345   -0.9389    0.7147 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1084   -0.4202    1.9468 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0375   -1.4937    3.2053 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.7464   -2.7798    2.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5118   -1.9792    3.7206 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8421   -0.8926    4.5372 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472   -1.0366   -0.1818 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5612   -2.0101   -1.1414 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6361   -3.2983   -1.0921 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.8673   -4.5969   -1.1928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6711   -3.2275   -2.4353 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5258   -3.3436    0.3443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4914    3.2291    0.6591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9707    2.3828   -2.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9332    0.0767   -1.6979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5298   -0.0328   -2.1644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1038    1.7676   -3.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8596    1.7110   -0.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1556    4.6916    1.7628 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625    4.3887   -0.5933 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2564    0.0651    0.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0417   -3.1409   -1.8574 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1290    0.2212   -1.7124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6727   -1.9710    0.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4131   -2.7321    4.3762 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9569   -1.6313    5.1830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7383   -1.3181    0.4241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2994   -3.9657   -2.4649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3233   -2.7678    0.2185 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
  9 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 17 20  1  0
 15 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 23 26  1  0
 21 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 29 32  1  0
 27  6  1  0
  3 33  1  0
  4 34  1  0
  6 35  1  6
  7 36  1  6
  8 37  1  0
  9 38  1  6
 13 39  1  0
 14 40  1  0
 15 41  1  1
 19 42  1  0
 20 43  1  0
 21 44  1  1
 25 45  1  0
 26 46  1  0
 27 47  1  1
 31 48  1  0
 32 49  1  0
M  END

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       4.001   2.310   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0       4.001   5.390   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0       1.897   5.954   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0       3.437   3.286   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0       6.105  -1.334   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0       4.565   1.334   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0       6.668   0.770   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0       0.206   3.850   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0      -2.874   3.850   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -1.334   5.390   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       4.001  -3.850   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       1.897  -4.414   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       3.437  -1.746   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      -4.001   0.770   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -1.897   1.334   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -3.437  -1.334   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       1.334   3.850   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       4.001  -0.770   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       1.334  -2.310   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      -1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   28  P   UNK     0       2.667   4.620   0.000  0.00  0.00           P+0
HETATM   29  P   UNK     0       5.335   0.000   0.000  0.00  0.00           P+0
HETATM   30  P   UNK     0      -1.334   3.850   0.000  0.00  0.00           P+0
HETATM   31  P   UNK     0       2.667  -3.080   0.000  0.00  0.00           P+0
HETATM   32  P   UNK     0      -2.667   0.000   0.000  0.00  0.00           P+0
HETATM   33  H   UNK     0       2.667   3.080   0.000  0.00  0.00           H+0
HETATM   34  H   UNK     0       0.000   3.080   0.000  0.00  0.00           H+0
HETATM   35  H   UNK     0       2.667  -1.540   0.000  0.00  0.00           H+0
HETATM   36  H   UNK     0       1.334   0.770   0.000  0.00  0.00           H+0
HETATM   37  H   UNK     0       0.000  -1.540   0.000  0.00  0.00           H+0
HETATM   38  H   UNK     0      -1.334   0.770   0.000  0.00  0.00           H+0
CONECT    1    2    3    7   33                                             
CONECT    2    1    4   23   34                                             
CONECT    3    1    5   24   35                                             
CONECT    4    2    6   25   36                                             
CONECT    5    3    6   26   37                                             
CONECT    6    4    5   27   38                                             
CONECT    7    1                                                            
CONECT    8   28                                                            
CONECT    9   28                                                            
CONECT   10   28                                                            
CONECT   11   29                                                            
CONECT   12   29                                                            
CONECT   13   29                                                            
CONECT   14   30                                                            
CONECT   15   30                                                            
CONECT   16   30                                                            
CONECT   17   31                                                            
CONECT   18   31                                                            
CONECT   19   31                                                            
CONECT   20   32                                                            
CONECT   21   32                                                            
CONECT   22   32                                                            
CONECT   23    2   28                                                       
CONECT   24    3   29                                                       
CONECT   25    4   30                                                       
CONECT   26    5   31                                                       
CONECT   27    6   32                                                       
CONECT   28    8    9   10   23                                             
CONECT   29   11   12   13   24                                             
CONECT   30   14   15   16   25                                             
CONECT   31   17   18   19   26                                             
CONECT   32   20   21   22   27                                             
CONECT   33    1                                                            
CONECT   34    2                                                            
CONECT   35    3                                                            
CONECT   36    4                                                            
CONECT   37    5                                                            
CONECT   38    6                                                            
MASTER        0    0    0    0    0    0    0    0   38    0   76    0
END

COMPND    HMDB0003529
HETATM    1  O1  UNL     1      -4.173   0.868  -0.640  1.00  0.00           O  
HETATM    2  P1  UNL     1      -3.108   1.894  -0.400  1.00  0.00           P  
HETATM    3  O2  UNL     1      -3.607   2.840   0.924  1.00  0.00           O  
HETATM    4  O3  UNL     1      -3.046   2.909  -1.742  1.00  0.00           O  
HETATM    5  O4  UNL     1      -1.618   1.230  -0.016  1.00  0.00           O  
HETATM    6  C1  UNL     1      -1.199   0.252  -0.886  1.00  0.00           C  
HETATM    7  C2  UNL     1       0.060   0.767  -1.578  1.00  0.00           C  
HETATM    8  O5  UNL     1      -0.200   1.909  -2.322  1.00  0.00           O  
HETATM    9  C3  UNL     1       1.005   1.165  -0.464  1.00  0.00           C  
HETATM   10  O6  UNL     1       0.422   2.000   0.463  1.00  0.00           O  
HETATM   11  P2  UNL     1       1.223   3.498   0.550  1.00  0.00           P  
HETATM   12  O7  UNL     1       2.192   3.428   1.731  1.00  0.00           O  
HETATM   13  O8  UNL     1       0.131   4.764   0.806  1.00  0.00           O  
HETATM   14  O9  UNL     1       2.110   3.794  -0.861  1.00  0.00           O  
HETATM   15  C4  UNL     1       1.485  -0.147   0.156  1.00  0.00           C  
HETATM   16  O10 UNL     1       2.003  -0.866  -0.922  1.00  0.00           O  
HETATM   17  P3  UNL     1       3.637  -1.192  -0.775  1.00  0.00           P  
HETATM   18  O11 UNL     1       4.216  -0.723   0.530  1.00  0.00           O  
HETATM   19  O12 UNL     1       3.847  -2.870  -0.912  1.00  0.00           O  
HETATM   20  O13 UNL     1       4.509  -0.476  -2.035  1.00  0.00           O  
HETATM   21  C5  UNL     1       0.335  -0.939   0.715  1.00  0.00           C  
HETATM   22  O14 UNL     1      -0.108  -0.420   1.947  1.00  0.00           O  
HETATM   23  P4  UNL     1       0.037  -1.494   3.205  1.00  0.00           P  
HETATM   24  O15 UNL     1       0.746  -2.780   2.774  1.00  0.00           O  
HETATM   25  O16 UNL     1      -1.512  -1.979   3.721  1.00  0.00           O  
HETATM   26  O17 UNL     1       0.842  -0.893   4.537  1.00  0.00           O  
HETATM   27  C6  UNL     1      -0.847  -1.037  -0.182  1.00  0.00           C  
HETATM   28  O18 UNL     1      -0.561  -2.010  -1.141  1.00  0.00           O  
HETATM   29  P5  UNL     1      -1.636  -3.298  -1.092  1.00  0.00           P  
HETATM   30  O19 UNL     1      -0.867  -4.597  -1.193  1.00  0.00           O  
HETATM   31  O20 UNL     1      -2.671  -3.227  -2.435  1.00  0.00           O  
HETATM   32  O21 UNL     1      -2.526  -3.344   0.344  1.00  0.00           O  
HETATM   33  H1  UNL     1      -4.491   3.229   0.659  1.00  0.00           H  
HETATM   34  H2  UNL     1      -2.971   2.383  -2.585  1.00  0.00           H  
HETATM   35  H3  UNL     1      -1.933   0.077  -1.698  1.00  0.00           H  
HETATM   36  H4  UNL     1       0.530  -0.033  -2.164  1.00  0.00           H  
HETATM   37  H5  UNL     1      -0.104   1.768  -3.287  1.00  0.00           H  
HETATM   38  H6  UNL     1       1.860   1.711  -0.911  1.00  0.00           H  
HETATM   39  H7  UNL     1      -0.156   4.692   1.763  1.00  0.00           H  
HETATM   40  H8  UNL     1       2.863   4.389  -0.593  1.00  0.00           H  
HETATM   41  H9  UNL     1       2.256   0.065   0.895  1.00  0.00           H  
HETATM   42  H10 UNL     1       4.042  -3.141  -1.857  1.00  0.00           H  
HETATM   43  H11 UNL     1       5.129   0.221  -1.712  1.00  0.00           H  
HETATM   44  H12 UNL     1       0.673  -1.971   0.949  1.00  0.00           H  
HETATM   45  H13 UNL     1      -1.413  -2.732   4.376  1.00  0.00           H  
HETATM   46  H14 UNL     1       0.957  -1.631   5.183  1.00  0.00           H  
HETATM   47  H15 UNL     1      -1.738  -1.318   0.424  1.00  0.00           H  
HETATM   48  H16 UNL     1      -3.299  -3.966  -2.465  1.00  0.00           H  
HETATM   49  H17 UNL     1      -3.323  -2.768   0.218  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4    5
CONECT    3   33
CONECT    4   34
CONECT    5    6
CONECT    6    7   27   35
CONECT    7    8    9   36
CONECT    8   37
CONECT    9   10   15   38
CONECT   10   11
CONECT   11   12   12   13   14
CONECT   13   39
CONECT   14   40
CONECT   15   16   21   41
CONECT   16   17
CONECT   17   18   18   19   20
CONECT   19   42
CONECT   20   43
CONECT   21   22   27   44
CONECT   22   23
CONECT   23   24   24   25   26
CONECT   25   45
CONECT   26   46
CONECT   27   28   47
CONECT   28   29
CONECT   29   30   30   31   32
CONECT   31   48
CONECT   32   49
END

HMDB0003529
     RDKit          3D
myo-Inositol 1,3,4,5,6-pentakisphosphate
 49 49  0  0  0  0  0  0  0  0999 V2000
   -4.1732    0.8681   -0.6397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1076    1.8943   -0.3999 P   0  0  0  0  0  5  0  0  0  0  0  0
   -3.6075    2.8397    0.9241 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0459    2.9095   -1.7421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6184    1.2299   -0.0158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1988    0.2516   -0.8861 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0596    0.7674   -1.5776 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2000    1.9086   -2.3216 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0054    1.1652   -0.4645 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4217    1.9995    0.4634 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234    3.4980    0.5504 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.1917    3.4285    1.7309 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1308    4.7640    0.8064 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    3.7938   -0.8613 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4854   -0.1473    0.1565 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0034   -0.8659   -0.9225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6367   -1.1920   -0.7754 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.2158   -0.7232    0.5304 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8470   -2.8703   -0.9125 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5094   -0.4761   -2.0355 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3345   -0.9389    0.7147 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1084   -0.4202    1.9468 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0375   -1.4937    3.2053 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.7464   -2.7798    2.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5118   -1.9792    3.7206 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8421   -0.8926    4.5372 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472   -1.0366   -0.1818 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5612   -2.0101   -1.1414 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6361   -3.2983   -1.0921 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.8673   -4.5969   -1.1928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6711   -3.2275   -2.4353 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5258   -3.3436    0.3443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4914    3.2291    0.6591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9707    2.3828   -2.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9332    0.0767   -1.6979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5298   -0.0328   -2.1644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1038    1.7676   -3.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8596    1.7110   -0.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1556    4.6916    1.7628 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625    4.3887   -0.5933 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2564    0.0651    0.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0417   -3.1409   -1.8574 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1290    0.2212   -1.7124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6727   -1.9710    0.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4131   -2.7321    4.3762 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9569   -1.6313    5.1830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7383   -1.3181    0.4241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2994   -3.9657   -2.4649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3233   -2.7678    0.2185 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
  9 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 17 20  1  0
 15 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 23 26  1  0
 21 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 29 32  1  0
 27  6  1  0
  3 33  1  0
  4 34  1  0
  6 35  1  6
  7 36  1  6
  8 37  1  0
  9 38  1  6
 13 39  1  0
 14 40  1  0
 15 41  1  1
 19 42  1  0
 20 43  1  0
 21 44  1  1
 25 45  1  0
 26 46  1  0
 27 47  1  1
 31 48  1  0
 32 49  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
1D-myo-Inositol 1,3,4,5,6-pentakisphosphate	ChEBI
D-myo-Inositol 1,3,4,5,6-pentakisphosphate	ChEBI
1D-myo-Inositol 1,3,4,5,6-pentakisphosphoric acid	Generator
Inositol 1,3,4,5,6-pentakisphosphoric acid	Generator
D-myo-Inositol 1,3,4,5,6-pentakisphosphoric acid	Generator
Inositol 1,3,4,5,6-pentaphosphate	HMDB
Inositol pentaphosphate	HMDB
myo-Inositol 1,3,4,5,6-pentakis(phosphate)	HMDB
myo-Inositol 1,3,4,5,6-pentaphosphate	HMDB
myo-Inositol pentakisphosphate	HMDB
I(1,3,4,5,6)P5	HMDB
Inositol 1,3,4,5,6-pentakisphosphate	HMDB
Ins(1,3,4,5,6)P5	HMDB
myo-inositol 1,3,4,5,6-pentakisphosphate	HMDB

Chemical Formula

C₆H₁₇O₂₁P₅

Average Molecular Weight

580.0554

Monoisotopic Molecular Weight

579.895040166

IUPAC Name

{[(1R,2S,3r,4R,5S,6r)-3-hydroxy-2,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid

Traditional Name

[(1R,2S,3r,4R,5S,6r)-3-hydroxy-2,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxyphosphonic acid

CAS Registry Number

20298-95-7

SMILES

O[C@@H]1[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@@H]1OP(O)(O)=O

InChI Identifier

InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2+,3-,4-,5+,6+

InChI Key

CTPQAXVNYGZUAJ-KXXVROSKSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as inositol phosphates. Inositol phosphates are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Alcohols and polyols

Direct Parent

Inositol phosphates

Alternative Parents

Substituents

Inositol phosphate
Monoalkyl phosphate
Cyclohexanol
Alkyl phosphate
Phosphoric acid ester
Organic phosphoric acid derivative
Secondary alcohol
Organic oxide
Hydrocarbon derivative
Aliphatic homomonocyclic compound

Molecular Framework

Aliphatic homomonocyclic compounds

External Descriptors

myo-inositol pentakisphosphate (CHEBI:16322 )

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Cytoplasm (HMDB: HMDB0003529)
Nucleus (HMDB: HMDB0003529)

Source

Endogenous

Endogenous (HMDB: HMDB0003529)

Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)
Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)

Equine

Horse (FooDB: FOOD00378)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Vegetable

Cabbage

Onion-family vegetable

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Jute (FooDB: FOOD00389)
Lambsquarters (FooDB: FOOD00394)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)

Fruit vegetable

Pepper (FooDB: FOOD00040)
Olive (FooDB: FOOD00121)
Avocado (FooDB: FOOD00130)
Garden tomato (FooDB: FOOD00171)
Cherry tomato (FooDB: FOOD00172)
Garden tomato (var.) (FooDB: FOOD00173)
Eggplant (FooDB: FOOD00174)
Pepper (C. baccatum) (FooDB: FOOD00231)
Pepper (C. chinense) (FooDB: FOOD00232)
Pepper (Capsicum) (FooDB: FOOD00233)
Groundcherry (FooDB: FOOD00371)
Pepper (C. frutescens) (FooDB: FOOD00428)
Mexican groundcherry (FooDB: FOOD00491)
Pepper (C. pubescens) (FooDB: FOOD00849)
Green bell pepper (FooDB: FOOD00877)
Yellow bell pepper (FooDB: FOOD00878)
Orange bell pepper (FooDB: FOOD00879)
Red bell pepper (FooDB: FOOD00880)
Italian sweet red pepper (FooDB: FOOD00881)
Jalapeno pepper (FooDB: FOOD00955)
Cubanelle pepper (FooDB: FOOD00971)

Tuber

Stalk vegetable

Other vegetable

Giant butterbur (FooDB: FOOD00314)
Carob (FooDB: FOOD00321)
Chinese water chestnut (FooDB: FOOD00332)
Horseradish tree (FooDB: FOOD00379)
Sacred lotus (FooDB: FOOD00402)
Nopal (FooDB: FOOD00416)
Okra (FooDB: FOOD00420)
Sesbania flower (FooDB: FOOD00469)
Agave (FooDB: FOOD00563)
Narrowleaf cattail (FooDB: FOOD00564)
Heart of palm (FooDB: FOOD00718)
Tree fern (FooDB: FOOD00797)

Mushroom

Castanospermum australe (FooDB: FOOD00893)
Gentiana lutea (FooDB: FOOD00894)
Juniperus communis (FooDB: FOOD00895)
Albizia gummifera (FooDB: FOOD00896)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Pummelo (FooDB: FOOD00055)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Bilberry (FooDB: FOOD00193)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Cascade huckleberry (FooDB: FOOD00220)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)

Other fruit

Fig (FooDB: FOOD00081)
Date (FooDB: FOOD00135)
Jujube (FooDB: FOOD00388)

Drupe

Prunus (Cherry, Plum) (FooDB: FOOD00143)
Apricot (FooDB: FOOD00144)
Sweet cherry (FooDB: FOOD00145)
Sour cherry (FooDB: FOOD00146)
European plum (FooDB: FOOD00147)
Peach (FooDB: FOOD00149)
Nectarine (FooDB: FOOD00229)
Peach (var.) (FooDB: FOOD00230)
Common chokecherry (FooDB: FOOD00562)

Nut

Cashew nut (FooDB: FOOD00011)
Peanut (FooDB: FOOD00016)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Pili nut (FooDB: FOOD00432)
Colorado pinyon (FooDB: FOOD00433)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)

Cereal and cereal product

Cereal

Cereal product

Pasta (FooDB: FOOD00273)
Bulgur (FooDB: FOOD00741)
Semolina (FooDB: FOOD00745)
Flour (FooDB: FOOD00799)

Dough

Sourdough (FooDB: FOOD00275)

Leavened bread

Flat bread

Other bread

Potato bread (FooDB: FOOD00811)

Sweet bread

Raisin bread (FooDB: FOOD00817)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

Lupine (FooDB: FOOD00104)
White lupine (FooDB: FOOD00403)

Bean

Green lentil (FooDB: FOOD00970)

Gourd

Watermelon (FooDB: FOOD00052)
Muskmelon (FooDB: FOOD00064)
Cucumber (FooDB: FOOD00065)
Cucurbita (FooDB: FOOD00066)
Bitter gourd (FooDB: FOOD00115)
Winter squash (FooDB: FOOD00283)
Butternut squash (FooDB: FOOD00317)
Calabash (FooDB: FOOD00318)
Chayote (FooDB: FOOD00325)
Towel gourd (FooDB: FOOD00492)
Wax gourd (FooDB: FOOD00499)
Tinda (FooDB: FOOD00559)
Horned melon (FooDB: FOOD00761)
Sunburst squash (pattypan squash) (FooDB: FOOD00874)
Green zucchini (FooDB: FOOD00875)
Yellow zucchini (FooDB: FOOD00876)
Japanese pumpkin (FooDB: FOOD00886)
Acorn squash (FooDB: FOOD00972)
Cantaloupe melon (FooDB: FOOD00984)

Coffee and coffee product

Coffee

Arabica coffee (FooDB: FOOD00059)
Robusta coffee (FooDB: FOOD00060)

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Soy sauce (FooDB: FOOD00694)
Miso (FooDB: FOOD00695)
Tofu (FooDB: FOOD00696)
Soy milk (FooDB: FOOD00736)
Soy cream (FooDB: FOOD00784)

Dish

Other dish

Taco shell (FooDB: FOOD00991)
Tostada shell (FooDB: FOOD00992)

Tea

Herbal tea

Hibiscus tea (FooDB: FOOD00723)
Greenthread tea (FooDB: FOOD00820)

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Inositol Metabolism (HMDB: HMDB0003529)
Inositol Phosphate Metabolism (HMDB: HMDB0003529)
Inositol Phosphate Metabolism (PathBank: SMP0002394)
Inositol Metabolism (PathBank: SMP0002397)
Phytate Biosynthesis (PathBank: SMP0012028)

Inositol Metabolism (HMDB: HMDB0003529)

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	-7.999	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	13.4 g/L	ALOGPS
logP	-0.14	ALOGPS
logP	-4.4	ChemAxon
logS	-1.6	ALOGPS
pKa (Strongest Acidic)	0.19	ChemAxon
Physiological Charge	-10	ChemAxon
Hydrogen Acceptor Count	16	ChemAxon
Hydrogen Donor Count	11	ChemAxon
Polar Surface Area	354.03 Å²	ChemAxon
Rotatable Bond Count	10	ChemAxon
Refractivity	90.14 m³·mol⁻¹	ChemAxon
Polarizability	38.48 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	218.663	31661259
DarkChem	[M-H]-	209.351	31661259
DeepCCS	[M+H]+	174.315	30932474
DeepCCS	[M-H]-	172.49	30932474
DeepCCS	[M-2H]-	205.732	30932474
DeepCCS	[M+Na]+	179.921	30932474
AllCCS	[M+H]+	205.3	32859911
AllCCS	[M+H-H2O]+	203.9	32859911
AllCCS	[M+NH4]+	206.6	32859911
AllCCS	[M+Na]+	207.0	32859911
AllCCS	[M-H]-	189.4	32859911
AllCCS	[M+Na-2H]-	189.9	32859911
AllCCS	[M+HCOO]-	190.6	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
myo-Inositol 1,3,4,5,6-pentakisphosphate	O[C@@H]1[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@@H]1OP(O)(O)=O	3763.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate	O[C@@H]1[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@@H]1OP(O)(O)=O	3282.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate	O[C@@H]1[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@@H]1OP(O)(O)=O	4755.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3632.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #2	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3722.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #3	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3722.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #4	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3721.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O	3722.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,isomer #6	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	3722.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3642.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3882.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6452.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #10	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3706.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #10	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3998.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #10	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6302.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3658.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	4010.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	6273.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #12	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3705.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #12	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3998.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #12	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	6301.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #13	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3705.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #13	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3998.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #13	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6301.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #14	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3705.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #14	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3997.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #14	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	6300.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #15	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3656.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #15	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	4011.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #15	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	6270.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3705.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3997.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	6300.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3705.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3998.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	6300.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #18	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3658.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #18	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	4010.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #18	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	6273.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3706.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3998.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	6302.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3643.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3882.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6452.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #20	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	3658.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #20	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	4012.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #20	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	6275.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3642.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3883.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6452.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3643.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3882.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6452.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3642.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3882.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6452.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #6	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3658.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #6	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	4012.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #6	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	6275.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #7	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3706.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #7	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3998.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #7	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6302.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #8	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3705.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #8	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3998.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #8	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	6301.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #9	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3705.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #9	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3998.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TMS,isomer #9	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6300.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3659.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3907.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6095.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3657.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3906.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6095.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3698.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3896.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6121.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3698.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3897.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6121.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3659.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3905.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6095.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3700.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3896.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6121.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3659.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3907.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	6095.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3724.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4003.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #16	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5969.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3723.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	4004.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	5969.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3723.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	4003.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	5968.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3723.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4004.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #19	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5969.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3700.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3896.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6121.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #20	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	3724.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #20	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	4003.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #20	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	5969.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	3756.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	3989.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	5996.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #22	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3757.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #22	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3989.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #22	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5995.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3756.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3989.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5996.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3721.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4004.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5967.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #25	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3754.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #25	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3990.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #25	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	5995.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #26	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3753.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #26	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3990.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #26	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5997.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3720.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	4003.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5964.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3754.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3989.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5995.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #29	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3722.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #29	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	4004.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #29	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5967.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3698.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3897.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6121.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #30	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3721.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #30	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	4004.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #30	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	5967.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #31	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3720.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #31	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	4004.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #31	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5967.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3721.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	4004.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5966.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3723.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4004.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5969.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3753.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3990.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5997.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #35	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3754.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #35	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3990.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #35	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	5995.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1OP(=O)(O)O	3720.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1OP(=O)(O)O	4004.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1OP(=O)(O)O	5967.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3751.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3990.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5996.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #38	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3720.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #38	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	4004.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #38	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5964.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O	3720.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O	4004.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O	5964.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3700.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3896.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6121.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #40	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	3720.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #40	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	4003.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #40	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	5964.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3721.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4004.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5966.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3754.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3989.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5995.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3723.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4003.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5968.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	3722.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	4004.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	5967.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3723.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	4004.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5969.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3700.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3897.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6122.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3659.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3905.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6095.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3698.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3896.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6121.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3698.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3896.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	6121.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3700.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3896.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,3TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	6121.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3677.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3881.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3712.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3872.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5843.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3714.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3874.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3677.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3881.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3716.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3874.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3679.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3882.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5823.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3674.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3880.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3674.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3880.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #17	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3677.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #17	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3881.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #17	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5823.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3673.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3880.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3710.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3870.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5842.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3676.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #20	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3712.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #20	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3872.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #20	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3674.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3880.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3713.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3872.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3677.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3881.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #23	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3673.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3880.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #24	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3675.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5823.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3674.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3880.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3713.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3871.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3676.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #29	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3677.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #29	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #29	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5823.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3677.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3881.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5823.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #30	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3677.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #30	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3881.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #30	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5823.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3723.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3960.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	5701.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3753.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3951.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #32	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5716.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3752.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3951.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3753.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3951.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5716.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #35	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3718.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #35	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3961.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #35	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	5698.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3751.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3951.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3752.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3952.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #37	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5715.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #38	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3718.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #38	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3960.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #38	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	5696.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3751.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3951.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #39	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3679.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3882.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5823.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #40	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3720.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #40	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3961.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #40	C[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	5698.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3753.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3951.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #41	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5716.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3752.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3951.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #42	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	3753.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	3951.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #43	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	5716.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3799.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3937.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #44	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5734.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3797.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	3938.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #45	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H]1OP(=O)(O)O	5733.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #46	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	3750.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #46	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	3952.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #46	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3748.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3951.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #47	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5711.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #48	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3797.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #48	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3938.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #48	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5733.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #49	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3750.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #49	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3952.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #49	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3677.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #50	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3747.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #50	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #50	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #51	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3748.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #51	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3952.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #51	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #52	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3747.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #52	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	3952.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #52	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	5711.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #53	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3794.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #53	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3939.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #53	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5733.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #54	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3748.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #54	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #54	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #55	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3747.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #55	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3952.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #55	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5711.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #56	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3748.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #56	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #56	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #57	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	3718.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #57	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	3961.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #57	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C	5698.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #58	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3748.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #58	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3952.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #58	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #59	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3747.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #59	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #59	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3713.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3871.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5843.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #60	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3713.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #60	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	3962.4	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #60	C[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C	5696.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #61	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3746.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #61	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3953.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #61	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #62	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3714.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #62	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3962.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #62	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	5693.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #63	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3752.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #63	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3952.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #63	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5715.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #64	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3751.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #64	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3951.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #64	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #65	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H]1OP(=O)(O)O	3748.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #65	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H]1OP(=O)(O)O	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #65	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H]1OP(=O)(O)O	5713.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #66	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3794.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #66	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3939.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #66	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5733.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #67	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3747.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #67	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	3952.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #67	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	5711.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #68	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3746.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #68	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3953.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #68	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #69	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3746.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #69	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3952.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #69	C[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5711.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3713.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	3872.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1OP(=O)(O)O	5843.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #70	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3714.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #70	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3962.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #70	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	5693.9	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #71	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3747.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #71	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	3952.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #71	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C	5711.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #72	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3718.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #72	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	3960.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #72	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C	5696.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #73	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3748.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #73	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3952.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #73	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5712.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #74	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3751.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #74	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3951.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #74	C[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	5714.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #75	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3720.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #75	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	3961.9	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #75	C[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	5698.3	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3716.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	3874.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C	5843.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3675.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3881.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	5823.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3840.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3954.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3955.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	3953.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O	3955.6	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O	3954.5	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3990.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4167.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6526.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4089.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4227.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	6408.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4039.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4229.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	6395.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	4089.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	4227.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@H]1O	6408.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	4086.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	4227.2	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	6408.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4087.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4227.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	6407.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4041.8	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4228.6	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	6392.6	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4087.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4227.0	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	6407.0	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4091.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	4227.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O	6407.1	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4039.9	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4229.3	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	6395.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4089.1	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4227.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](O)[C@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	6408.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3991.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4167.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6525.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C(C)(C)C	4044.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C(C)(C)C	4229.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O)O[Si](C)(C)C(C)(C)C	6397.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	3990.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4168.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6525.8	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	3991.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	4167.8	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	6525.7	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	3990.7	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	4167.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	6526.2	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4044.3	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	4229.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O)O[Si](C)(C)C(C)(C)C	6397.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4093.0	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	4227.7	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O	6408.5	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	4089.4	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	4227.5	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1OP(=O)(O)O	6408.4	Standard polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	4091.2	Semi standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	4227.1	Standard non polar	33892256
myo-Inositol 1,3,4,5,6-pentakisphosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1OP(=O)(O)O	6407.1	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (Non-derivatized) - 70eV, Positive	splash10-000t-9022820000-0b347c8feac8081572f2	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (1 TMS) - 70eV, Positive	splash10-0udj-8421291000-e7a6038279ed0bab458b	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS ("myo-Inositol 1,3,4,5,6-pentakisphosphate,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate GC-MS (TBDMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0udi-1000900000-189387da7b3691739738	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-001i-0009000000-d8e4bd96982581664cb8	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-06si-0976000000-4348a6ca785e225be82b	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0udi-0000900000-73573d716178b0ffb8dd	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0udi-0109000000-21271275bbff7f497e41	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-08gi-0977000000-4950d48887941a016c30	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-004i-9000000000-46d4cee1b5ac630ba9b8	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-052r-0900000000-4df79b7aad7183429c3e	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0a4i-0941000000-ebf11ba55edea9d0d03c	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0udi-0109000000-4701557ed0d5f78bceee	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-0a4i-0970000000-64206d567dce176ff875	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-001i-0009200000-ddb1fa1c37d0ac5a6c75	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate n/a 40V, negative-QTOF	splash10-06ri-0977000000-778f76090718afa48252	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 23V, negative-QTOF	splash10-004i-0000090000-09b887f4588457992521	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 26V, negative-QTOF	splash10-004i-0000290000-99907810b58601057eb2	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 30V, negative-QTOF	splash10-0059-0000890000-1db30e238cc14e69ef7c	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 32V, negative-QTOF	splash10-003r-0000940000-cdf319ca2ef7756b6fa2	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 39V, negative-QTOF	splash10-001i-0102900000-2a426dc0f4578da92fc2	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate Orbitrap 49V, negative-QTOF	splash10-0kcr-0816900000-c79cbf49bffaaf498cbe	2020-07-22	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 10V, Positive-QTOF	splash10-001i-2000590000-a78e46f1069068bb0c1a	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 20V, Positive-QTOF	splash10-01q9-1000390000-aeca364d94e2aaa6c4d6	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 40V, Positive-QTOF	splash10-001i-2019200000-69fb19c69da99cd9f2d2	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 10V, Negative-QTOF	splash10-004i-4000190000-e7d2cc4d7c8bcd94a4e4	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 20V, Negative-QTOF	splash10-004i-9000220000-c245a52aad69af0e69ae	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - myo-Inositol 1,3,4,5,6-pentakisphosphate 40V, Negative-QTOF	splash10-004i-9000000000-2809ce202dff18cc242c	2016-09-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Nucleus

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Name	SMPDB/PathBank	KEGG
Inositol phosphate metabolism	Not Available
Inositol Phosphate Metabolism

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB023187

KNApSAcK ID

Not Available

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

16322

Food Biomarker Ontology

Not Available

VMH ID

MI13456P

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Riley AM, Trusselle M, Kuad P, Borkovec M, Cho J, Choi JH, Qian X, Shears SB, Spiess B, Potter BV: scyllo-inositol pentakisphosphate as an analogue of myo-inositol 1,3,4,5,6-pentakisphosphate: chemical synthesis, physicochemistry and biological applications. Chembiochem. 2006 Jul;7(7):1114-22. [PubMed:16755629 ]
Barker CJ, Wright J, Hughes PJ, Kirk CJ, Michell RH: Complex changes in cellular inositol phosphate complement accompany transit through the cell cycle. Biochem J. 2004 Jun 1;380(Pt 2):465-73. [PubMed:14992690 ]

Enzymes

Enzyme Details

1. Inositol polyphosphate multikinase

General function:: Involved in inositol trisphosphate 3-kinase activity
Specific function:: Inositol phosphate kinase with a broad substrate specificity. Has a preference for inositol 1,4,5-trisphosphate (Ins(1,4,5)P3) and inositol 1,3,4,6-tetrakisphosphate (Ins(1,3,4,6)P4).
Gene Name:: IPMK
Uniprot ID:: Q8NFU5
Molecular weight:: 47221.455

Reactions

Adenosine triphosphate + D-myo-Inositol 1,4,5,6-tetrakisphosphate → ADP + myo-Inositol 1,3,4,5,6-pentakisphosphate	details
Adenosine triphosphate + myo-Inositol 1,4,5-trisphosphate → ADP + myo-Inositol 1,3,4,5,6-pentakisphosphate	details

Enzyme Details

2. Sedoheptulokinase

General function:: Involved in phosphotransferase activity, alcohol group as acceptor
Specific function:: Acts as a modulator of macrophage activation through control of glucose metabolism (By similarity).
Gene Name:: SHPK
Uniprot ID:: Q9UHJ6
Molecular weight:: 51504.425

Enzyme Details

3. Inositol-tetrakisphosphate 1-kinase

General function:: Involved in catalytic activity
Specific function:: Kinase that can phosphorylate various inositol polyphosphate such as Ins(3,4,5,6)P4 or Ins(1,3,4)P3. Phosphorylates Ins(3,4,5,6)P4 at position 1 to form Ins(1,3,4,5,6)P5. This reaction is thought to have regulatory importance, since Ins(3,4,5,6)P4 is an inhibitor of plasma membrane Ca(2+)-activated Cl(-) channels, while Ins(1,3,4,5,6)P5 is not. Also phosphorylates Ins(1,3,4)P3 on O-5 and O-6 to form Ins(1,3,4,6)P4, an essential molecule in the hexakisphosphate (InsP6) pathway. Also acts as an inositol polyphosphate phosphatase that dephosphorylate Ins(1,3,4,5)P4 and Ins(1,3,4,6)P4 to Ins(1,3,4)P3, and Ins(1,3,4,5,6)P5 to Ins(3,4,5,6)P4. May also act as an isomerase that interconverts the inositol tetrakisphosphate isomers Ins(1,3,4,5)P4 and Ins(1,3,4,6)P4 in the presence of ADP and magnesium. Probably acts as the rate-limiting enzyme of the InsP6 pathway. Modifies TNF-alpha-induced apoptosis by interfering with the activation of TNFRSF1A-associated death domain.
Gene Name:: ITPK1
Uniprot ID:: Q13572
Molecular weight:: 45620.645

Reactions

Adenosine triphosphate + D-myo-Inositol 3,4,5,6-tetrakisphosphate → ADP + myo-Inositol 1,3,4,5,6-pentakisphosphate	details

Enzyme Details

4. Inositol-pentakisphosphate 2-kinase

General function:: Involved in ATP binding
Specific function:: Phosphorylates Ins(1,3,4,5,6)P5 at position 2 to form Ins(1,2,3,4,5,6)P6 (InsP6 or phytate). InsP6 is involved in many processes such as mRNA export, non-homologous end-joining, endocytosis, ion channel regulation. It also protects cells from TNF-alpha-induced apoptosis.
Gene Name:: IPPK
Uniprot ID:: Q9H8X2
Molecular weight:: 56016.12

Reactions

myo-Inositol hexakisphosphate + ADP → myo-Inositol 1,3,4,5,6-pentakisphosphate + Adenosine triphosphate	details

Showing metabocard for myo-Inositol 1,3,4,5,6-pentakisphosphate (HMDB0003529)

MOL for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

3D MOL for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

3D SDF for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

3D-SDF for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

PDB for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

3D PDB for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

SMILES for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

INCHI for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

Structure for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

3D Structure for HMDB0003529 (myo-Inositol 1,3,4,5,6-pentakisphosphate)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

Reactions

Reactions

Reactions