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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 00:12:55 UTC

Update Date

2022-03-07 02:55:58 UTC

HMDB ID

HMDB0038867

Secondary Accession Numbers

HMDB38867

Metabolite Identification

Common Name

Diospyrin

Description

Diospyrin belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Diospyrin has been detected, but not quantified in, fruits and japanese persimmons (Diospyros kaki). This could make diospyrin a potential biomarker for the consumption of these foods. Based on a literature review a significant number of articles have been published on Diospyrin.

Structure

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


  Mrv0541 05061310422D          

 34 37  0  0  0  0            999 V2000
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    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
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  7  4  1  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 11  4  2  0  0  0  0
 12  5  1  0  0  0  0
 13  8  2  0  0  0  0
 13 11  1  0  0  0  0
 14  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16 13  1  0  0  0  0
 17 15  1  0  0  0  0
 18 17  1  0  0  0  0
 19  6  1  0  0  0  0
 20 16  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22  5  1  0  0  0  0
 23  7  1  0  0  0  0
 24  8  1  0  0  0  0
 25  9  1  0  0  0  0
 26 10  1  0  0  0  0
 27 14  1  0  0  0  0
 28 15  1  0  0  0  0
 29 16  1  0  0  0  0
 30 17  1  0  0  0  0
 31 18  1  0  0  0  0
 32 11  1  0  0  0  0
 32 19  1  0  0  0  0
 33 12  1  0  0  0  0
 33 21  1  0  0  0  0
 34 20  1  0  0  0  0
 34 21  1  0  0  0  0
M  END

HMDB0038867
     RDKit          3D
Diospyrin
 58 61  0  0  0  0  0  0  0  0999 V2000
    5.5372    0.6821   -1.9460 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8075    1.0945   -0.8311 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5490    0.2592   -0.8027 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7170    0.5738    0.2782 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5662   -0.2036    0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4689    0.3773    0.7233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5430    0.7614   -0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6061    2.2985    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3686    2.5817    1.3370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9327    2.8310   -0.3533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0528    4.1913   -0.4991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9833    5.0399   -0.3203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2702    4.7625   -0.8353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4018    4.0199   -1.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6286    4.5757   -1.3746 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2922    2.6550   -0.8936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0642    2.0794   -0.5546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9484    0.6979   -0.4075 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8497    0.2577    0.4011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9310   -1.2002    0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1833   -2.0313   -0.4912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2678   -3.4030   -0.3494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5199   -4.1981   -1.4342 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0961   -3.9574    0.8905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1666   -5.3201    1.1082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8383   -3.1542    2.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6692   -3.7485    3.2473 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7662   -1.8049    1.8012 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8564   -1.5602    0.6687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9674   -2.5425    0.2306 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2794   -1.9170    0.3920 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0854   -1.7848    1.5176 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8704   -1.2183   -0.8148 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2530   -1.3507   -0.7476 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3195    1.2304   -2.7418 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5837    2.1628   -0.8547 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4160    0.7978    0.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9729    0.4945   -1.7166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3675   -0.2411   -0.9740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3492    0.5062   -1.2005 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1483    2.7655   -0.6634 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5651    2.7595    1.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0820    4.6931   -0.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3567    5.8435   -0.9492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7712    5.5507   -1.4926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1575    2.0279   -1.0431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9663    0.7612    1.4079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3214   -1.6049   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6020   -5.1820   -1.4560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3465   -5.9484    0.3623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4840   -3.2469    4.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5652   -1.1538    2.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7567   -1.4571    1.7891 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3958   -3.4286    0.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2935   -3.0174    0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4717   -1.6758    2.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5349   -1.6908   -1.7573 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5985   -1.2903    0.1818 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  5 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  3  1  0
 19  7  1  0
 28 20  1  0
 17 10  1  0
  1 35  1  0
  2 36  1  0
  2 37  1  0
  3 38  1  0
  5 39  1  0
  7 40  1  0
  8 41  1  0
  9 42  1  0
 12 43  1  0
 13 44  1  0
 15 45  1  0
 16 46  1  0
 19 47  1  0
 21 48  1  0
 23 49  1  0
 25 50  1  0
 27 51  1  0
 28 52  1  0
 29 53  1  0
 30 54  1  0
 31 55  1  0
 32 56  1  0
 33 57  1  0
 34 58  1  0
M  END


  Mrv0541 05061310422D          

 34 37  0  0  0  0            999 V2000
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    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
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  7  4  1  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 11  4  2  0  0  0  0
 12  5  1  0  0  0  0
 13  8  2  0  0  0  0
 13 11  1  0  0  0  0
 14  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16 13  1  0  0  0  0
 17 15  1  0  0  0  0
 18 17  1  0  0  0  0
 19  6  1  0  0  0  0
 20 16  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22  5  1  0  0  0  0
 23  7  1  0  0  0  0
 24  8  1  0  0  0  0
 25  9  1  0  0  0  0
 26 10  1  0  0  0  0
 27 14  1  0  0  0  0
 28 15  1  0  0  0  0
 29 16  1  0  0  0  0
 30 17  1  0  0  0  0
 31 18  1  0  0  0  0
 32 11  1  0  0  0  0
 32 19  1  0  0  0  0
 33 12  1  0  0  0  0
 33 21  1  0  0  0  0
 34 20  1  0  0  0  0
 34 21  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0038867

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C21H24O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15-31H,5H2

> <INCHI_KEY>
XCZZWPJIGBONJX-UHFFFAOYSA-N

> <FORMULA>
C21H24O13

> <MOLECULAR_WEIGHT>
484.4075

> <EXACT_MASS>
484.121690854

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_AVERAGE_POLARIZABILITY>
46.09484561605965

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,5,7-triol

> <ALOGPS_LOGP>
-0.28

> <JCHEM_LOGP>
-1.1982900989999998

> <ALOGPS_LOGS>
-1.81

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.413533070679337

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.698903290763011

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6786219270207363

> <JCHEM_POLAR_SURFACE_AREA>
229.98999999999995

> <JCHEM_REFRACTIVITY>
109.6014

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
7.44e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,5,7-triol

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0038867
     RDKit          3D
Diospyrin
 58 61  0  0  0  0  0  0  0  0999 V2000
    5.5372    0.6821   -1.9460 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8075    1.0945   -0.8311 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5490    0.2592   -0.8027 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7170    0.5738    0.2782 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5662   -0.2036    0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4689    0.3773    0.7233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5430    0.7614   -0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6061    2.2985    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3686    2.5817    1.3370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9327    2.8310   -0.3533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0528    4.1913   -0.4991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9833    5.0399   -0.3203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2702    4.7625   -0.8353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4018    4.0199   -1.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6286    4.5757   -1.3746 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2922    2.6550   -0.8936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0642    2.0794   -0.5546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9484    0.6979   -0.4075 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8497    0.2577    0.4011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9310   -1.2002    0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1833   -2.0313   -0.4912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2678   -3.4030   -0.3494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5199   -4.1981   -1.4342 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0961   -3.9574    0.8905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1666   -5.3201    1.1082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8383   -3.1542    2.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6692   -3.7485    3.2473 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7662   -1.8049    1.8012 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8564   -1.5602    0.6687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9674   -2.5425    0.2306 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2794   -1.9170    0.3920 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0854   -1.7848    1.5176 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8704   -1.2183   -0.8148 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2530   -1.3507   -0.7476 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3195    1.2304   -2.7418 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5837    2.1628   -0.8547 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4160    0.7978    0.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9729    0.4945   -1.7166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3675   -0.2411   -0.9740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3492    0.5062   -1.2005 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1483    2.7655   -0.6634 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5651    2.7595    1.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0820    4.6931   -0.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3567    5.8435   -0.9492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7712    5.5507   -1.4926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1575    2.0279   -1.0431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9663    0.7612    1.4079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3214   -1.6049   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6020   -5.1820   -1.4560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3465   -5.9484    0.3623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4840   -3.2469    4.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5652   -1.1538    2.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7567   -1.4571    1.7891 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3958   -3.4286    0.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2935   -3.0174    0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4717   -1.6758    2.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5349   -1.6908   -1.7573 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5985   -1.2903    0.1818 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  5 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  3  1  0
 19  7  1  0
 28 20  1  0
 17 10  1  0
  1 35  1  0
  2 36  1  0
  2 37  1  0
  3 38  1  0
  5 39  1  0
  7 40  1  0
  8 41  1  0
  9 42  1  0
 12 43  1  0
 13 44  1  0
 15 45  1  0
 16 46  1  0
 19 47  1  0
 21 48  1  0
 23 49  1  0
 25 50  1  0
 27 51  1  0
 28 52  1  0
 29 53  1  0
 30 54  1  0
 31 55  1  0
 32 56  1  0
 33 57  1  0
 34 58  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.667  -7.700   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.001  -6.930   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.335  -7.700   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.668  -6.930   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       2.667  -9.240   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0      -2.667   0.000   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       9.336  -0.770   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0       9.336   2.310   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0       5.335  -9.240   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       2.667  -4.620   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       8.002  -7.700   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       8.002  -4.620   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       2.667   0.000   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0       4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
CONECT    1    6    9                                                       
CONECT    2    6   10                                                       
CONECT    3    7    8                                                       
CONECT    4    7   11                                                       
CONECT    5   12   22                                                       
CONECT    6    1    2   19                                                  
CONECT    7    3    4   23                                                  
CONECT    8    3   13   24                                                  
CONECT    9    1   14   25                                                  
CONECT   10    2   14   26                                                  
CONECT   11    4   13   32                                                  
CONECT   12    5   15   33                                                  
CONECT   13    8   11   16                                                  
CONECT   14    9   10   27                                                  
CONECT   15   12   17   28                                                  
CONECT   16   13   20   29                                                  
CONECT   17   15   18   30                                                  
CONECT   18   17   21   31                                                  
CONECT   19    6   20   32                                                  
CONECT   20   16   19   34                                                  
CONECT   21   18   33   34                                                  
CONECT   22    5                                                            
CONECT   23    7                                                            
CONECT   24    8                                                            
CONECT   25    9                                                            
CONECT   26   10                                                            
CONECT   27   14                                                            
CONECT   28   15                                                            
CONECT   29   16                                                            
CONECT   30   17                                                            
CONECT   31   18                                                            
CONECT   32   11   19                                                       
CONECT   33   12   21                                                       
CONECT   34   20   21                                                       
MASTER        0    0    0    0    0    0    0    0   34    0   74    0
END

COMPND    HMDB0038867
HETATM    1  O1  UNL     1       5.537   0.682  -1.946  1.00  0.00           O  
HETATM    2  C1  UNL     1       4.808   1.095  -0.831  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.549   0.259  -0.803  1.00  0.00           C  
HETATM    4  O2  UNL     1       2.717   0.574   0.278  1.00  0.00           O  
HETATM    5  C3  UNL     1       1.566  -0.204   0.099  1.00  0.00           C  
HETATM    6  O3  UNL     1       0.469   0.377   0.723  1.00  0.00           O  
HETATM    7  C4  UNL     1      -0.543   0.761  -0.139  1.00  0.00           C  
HETATM    8  C5  UNL     1      -0.606   2.299   0.004  1.00  0.00           C  
HETATM    9  O4  UNL     1      -0.369   2.582   1.337  1.00  0.00           O  
HETATM   10  C6  UNL     1      -1.933   2.831  -0.353  1.00  0.00           C  
HETATM   11  C7  UNL     1      -2.053   4.191  -0.499  1.00  0.00           C  
HETATM   12  O5  UNL     1      -0.983   5.040  -0.320  1.00  0.00           O  
HETATM   13  C8  UNL     1      -3.270   4.763  -0.835  1.00  0.00           C  
HETATM   14  C9  UNL     1      -4.402   4.020  -1.038  1.00  0.00           C  
HETATM   15  O6  UNL     1      -5.629   4.576  -1.375  1.00  0.00           O  
HETATM   16  C10 UNL     1      -4.292   2.655  -0.894  1.00  0.00           C  
HETATM   17  C11 UNL     1      -3.064   2.079  -0.555  1.00  0.00           C  
HETATM   18  O7  UNL     1      -2.948   0.698  -0.408  1.00  0.00           O  
HETATM   19  C12 UNL     1      -1.850   0.258   0.401  1.00  0.00           C  
HETATM   20  C13 UNL     1      -1.931  -1.200   0.578  1.00  0.00           C  
HETATM   21  C14 UNL     1      -2.183  -2.031  -0.491  1.00  0.00           C  
HETATM   22  C15 UNL     1      -2.268  -3.403  -0.349  1.00  0.00           C  
HETATM   23  O8  UNL     1      -2.520  -4.198  -1.434  1.00  0.00           O  
HETATM   24  C16 UNL     1      -2.096  -3.957   0.891  1.00  0.00           C  
HETATM   25  O9  UNL     1      -2.167  -5.320   1.108  1.00  0.00           O  
HETATM   26  C17 UNL     1      -1.838  -3.154   2.004  1.00  0.00           C  
HETATM   27  O10 UNL     1      -1.669  -3.748   3.247  1.00  0.00           O  
HETATM   28  C18 UNL     1      -1.766  -1.805   1.801  1.00  0.00           C  
HETATM   29  C19 UNL     1       1.856  -1.560   0.669  1.00  0.00           C  
HETATM   30  O11 UNL     1       0.967  -2.542   0.231  1.00  0.00           O  
HETATM   31  C20 UNL     1       3.279  -1.917   0.392  1.00  0.00           C  
HETATM   32  O12 UNL     1       4.085  -1.785   1.518  1.00  0.00           O  
HETATM   33  C21 UNL     1       3.870  -1.218  -0.815  1.00  0.00           C  
HETATM   34  O13 UNL     1       5.253  -1.351  -0.748  1.00  0.00           O  
HETATM   35  H1  UNL     1       5.320   1.230  -2.742  1.00  0.00           H  
HETATM   36  H2  UNL     1       4.584   2.163  -0.855  1.00  0.00           H  
HETATM   37  H3  UNL     1       5.416   0.798   0.060  1.00  0.00           H  
HETATM   38  H4  UNL     1       2.973   0.494  -1.717  1.00  0.00           H  
HETATM   39  H5  UNL     1       1.368  -0.241  -0.974  1.00  0.00           H  
HETATM   40  H6  UNL     1      -0.349   0.506  -1.201  1.00  0.00           H  
HETATM   41  H7  UNL     1       0.148   2.765  -0.663  1.00  0.00           H  
HETATM   42  H8  UNL     1       0.565   2.760   1.553  1.00  0.00           H  
HETATM   43  H9  UNL     1      -0.082   4.693  -0.076  1.00  0.00           H  
HETATM   44  H10 UNL     1      -3.357   5.843  -0.949  1.00  0.00           H  
HETATM   45  H11 UNL     1      -5.771   5.551  -1.493  1.00  0.00           H  
HETATM   46  H12 UNL     1      -5.157   2.028  -1.043  1.00  0.00           H  
HETATM   47  H13 UNL     1      -1.966   0.761   1.408  1.00  0.00           H  
HETATM   48  H14 UNL     1      -2.321  -1.605  -1.479  1.00  0.00           H  
HETATM   49  H15 UNL     1      -2.602  -5.182  -1.456  1.00  0.00           H  
HETATM   50  H16 UNL     1      -2.346  -5.948   0.362  1.00  0.00           H  
HETATM   51  H17 UNL     1      -1.484  -3.247   4.082  1.00  0.00           H  
HETATM   52  H18 UNL     1      -1.565  -1.154   2.658  1.00  0.00           H  
HETATM   53  H19 UNL     1       1.757  -1.457   1.789  1.00  0.00           H  
HETATM   54  H20 UNL     1       1.396  -3.429   0.434  1.00  0.00           H  
HETATM   55  H21 UNL     1       3.294  -3.017   0.136  1.00  0.00           H  
HETATM   56  H22 UNL     1       3.472  -1.676   2.292  1.00  0.00           H  
HETATM   57  H23 UNL     1       3.535  -1.691  -1.757  1.00  0.00           H  
HETATM   58  H24 UNL     1       5.599  -1.290   0.182  1.00  0.00           H  
CONECT    1    2   35
CONECT    2    3   36   37
CONECT    3    4   33   38
CONECT    4    5
CONECT    5    6   29   39
CONECT    6    7
CONECT    7    8   19   40
CONECT    8    9   10   41
CONECT    9   42
CONECT   10   11   11   17
CONECT   11   12   13
CONECT   12   43
CONECT   13   14   14   44
CONECT   14   15   16
CONECT   15   45
CONECT   16   17   17   46
CONECT   17   18
CONECT   18   19
CONECT   19   20   47
CONECT   20   21   21   28
CONECT   21   22   48
CONECT   22   23   24   24
CONECT   23   49
CONECT   24   25   26
CONECT   25   50
CONECT   26   27   28   28
CONECT   27   51
CONECT   28   52
CONECT   29   30   31   53
CONECT   30   54
CONECT   31   32   33   55
CONECT   32   56
CONECT   33   34   57
CONECT   34   58
END

HMDB0038867
     RDKit          3D
Diospyrin
 58 61  0  0  0  0  0  0  0  0999 V2000
    5.5372    0.6821   -1.9460 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8075    1.0945   -0.8311 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5490    0.2592   -0.8027 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7170    0.5738    0.2782 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5662   -0.2036    0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4689    0.3773    0.7233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5430    0.7614   -0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6061    2.2985    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3686    2.5817    1.3370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9327    2.8310   -0.3533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0528    4.1913   -0.4991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9833    5.0399   -0.3203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2702    4.7625   -0.8353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4018    4.0199   -1.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6286    4.5757   -1.3746 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2922    2.6550   -0.8936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0642    2.0794   -0.5546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9484    0.6979   -0.4075 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8497    0.2577    0.4011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9310   -1.2002    0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1833   -2.0313   -0.4912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2678   -3.4030   -0.3494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5199   -4.1981   -1.4342 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0961   -3.9574    0.8905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1666   -5.3201    1.1082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8383   -3.1542    2.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6692   -3.7485    3.2473 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7662   -1.8049    1.8012 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8564   -1.5602    0.6687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9674   -2.5425    0.2306 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2794   -1.9170    0.3920 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0854   -1.7848    1.5176 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8704   -1.2183   -0.8148 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2530   -1.3507   -0.7476 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3195    1.2304   -2.7418 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5837    2.1628   -0.8547 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4160    0.7978    0.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9729    0.4945   -1.7166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3675   -0.2411   -0.9740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3492    0.5062   -1.2005 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1483    2.7655   -0.6634 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5651    2.7595    1.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0820    4.6931   -0.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3567    5.8435   -0.9492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7712    5.5507   -1.4926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1575    2.0279   -1.0431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9663    0.7612    1.4079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3214   -1.6049   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6020   -5.1820   -1.4560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3465   -5.9484    0.3623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4840   -3.2469    4.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5652   -1.1538    2.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7567   -1.4571    1.7891 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3958   -3.4286    0.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2935   -3.0174    0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4717   -1.6758    2.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5349   -1.6908   -1.7573 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5985   -1.2903    0.1818 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 22 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  2  0
  5 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33  3  1  0
 19  7  1  0
 28 20  1  0
 17 10  1  0
  1 35  1  0
  2 36  1  0
  2 37  1  0
  3 38  1  0
  5 39  1  0
  7 40  1  0
  8 41  1  0
  9 42  1  0
 12 43  1  0
 13 44  1  0
 15 45  1  0
 16 46  1  0
 19 47  1  0
 21 48  1  0
 23 49  1  0
 25 50  1  0
 27 51  1  0
 28 52  1  0
 29 53  1  0
 30 54  1  0
 31 55  1  0
 32 56  1  0
 33 57  1  0
 34 58  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Diospyrin?	HMDB
Leucodelphinidin 3-glucoside	HMDB

Chemical Formula

C₂₁H₂₄O₁₃

Average Molecular Weight

484.4075

Monoisotopic Molecular Weight

484.121690854

IUPAC Name

3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,5,7-triol

Traditional Name

3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,5,7-triol

CAS Registry Number

27838-81-9

SMILES

OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O

InChI Identifier

InChI=1S/C21H24O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15-31H,5H2

InChI Key

XCZZWPJIGBONJX-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-3-O-glycosides

Alternative Parents

Substituents

Flavonoid-3-o-glycoside
Epigallocatechin
Catechin
Leucoanthocyanidin-skeleton
3'-hydroxyflavonoid
4'-hydroxyflavonoid
4-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Hydroxyflavonoid
Flavan
Hexose monosaccharide
O-glycosyl compound
Glycosyl compound
Benzopyran
1-benzopyran
Chromane
Benzenetriol
Pyrogallol derivative
Phenol
Alkyl aryl ether
1-hydroxy-2-unsubstituted benzenoid
1-hydroxy-4-unsubstituted benzenoid
Oxane
Monosaccharide
Monocyclic benzene moiety
Benzenoid
Secondary alcohol
Polyol
Oxacycle
Acetal
Ether
Organoheterocyclic compound
Organic oxygen compound
Alcohol
Primary alcohol
Hydrocarbon derivative
Organooxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0038867)
Cytoplasm (HMDB: HMDB0038867)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0038867)

Source

Exogenous

Food

Food (HMDB: HMDB0038867)

Fruit

Tropical fruit

Japanese persimmon (FooDB: FOOD00073)

Fruits (FooDB: FOOD00871)

Endogenous

Plant

Plant (HMDB: HMDB0038867)

Not Available

Nutrient (HMDB: HMDB0038867)

Physical Properties

State

Not Available

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	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	7.44 g/L	ALOGPS
logP	-0.28	ALOGPS
logP	-1.2	ChemAxon
logS	-1.8	ALOGPS
pKa (Strongest Acidic)	8.7	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	229.99 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	109.6 m³·mol⁻¹	ChemAxon
Polarizability	46.09 Å³	ChemAxon
Number of Rings	4	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]+	210.102	31661259
DarkChem	[M-H]-	204.369	31661259
DeepCCS	[M+H]+	202.708	30932474
DeepCCS	[M-H]-	200.313	30932474
DeepCCS	[M-2H]-	233.217	30932474
DeepCCS	[M+Na]+	208.621	30932474
AllCCS	[M+H]+	209.8	32859911
AllCCS	[M+H-H2O]+	207.6	32859911
AllCCS	[M+NH4]+	211.7	32859911
AllCCS	[M+Na]+	212.3	32859911
AllCCS	[M-H]-	205.4	32859911
AllCCS	[M+Na-2H]-	206.1	32859911
AllCCS	[M+HCOO]-	207.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Diospyrin	OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	5783.1	Standard polar	33892256
Diospyrin	OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4587.8	Standard non polar	33892256
Diospyrin	OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4671.0	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Diospyrin,1TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4629.4	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #2	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O)C1O	4656.2	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4711.6	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4741.7	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #5	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	4691.1	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #6	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)C=C1O	4692.8	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #7	C[Si](C)(C)OC1C(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)OC(CO)C(O)C1O	4688.0	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #8	C[Si](C)(C)OC1C(O)C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C1O	4697.9	Semi standard non polar	33892256
Diospyrin,1TMS,isomer #9	C[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C1O	4699.6	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4576.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4645.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #11	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	4606.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #12	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)C=C1O	4603.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #13	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	4593.1	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #14	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	4602.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #15	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	4600.1	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #16	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4632.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4639.4	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4639.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4633.7	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4610.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #20	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	4643.4	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4621.0	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4652.3	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #23	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4627.3	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #24	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4651.6	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #25	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4653.7	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #26	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4648.9	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #27	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O	4619.3	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #28	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4624.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #29	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4619.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4627.7	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #30	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4616.2	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #31	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4589.7	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #32	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C=C1O	4601.5	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #33	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C=C1O	4589.6	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #34	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C=C1O	4597.6	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #35	C[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O	4601.7	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #36	C[Si](C)(C)OC1C(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)OC(CO)C(O)C1O[Si](C)(C)C	4627.0	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #37	C[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C	4624.0	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4603.8	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O	4613.4	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4588.6	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4603.5	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4599.5	Semi standard non polar	33892256
Diospyrin,2TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4633.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4463.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O	4447.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4492.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4484.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4493.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4482.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O	4453.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4509.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4499.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4510.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4476.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4450.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4437.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4487.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4476.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4492.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4464.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4450.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4468.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4498.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4501.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4503.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4491.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #30	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4474.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4489.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4473.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #33	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4483.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #34	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	4458.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4432.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4468.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #37	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4434.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O[Si](C)(C)C	4502.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #39	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4487.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4481.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4497.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #41	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O	4466.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #42	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4449.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #43	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4465.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #44	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4448.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #45	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4427.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #46	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C=C1O	4449.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #47	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C=C1O	4418.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #48	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C=C1O	4437.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #49	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4480.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4476.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #50	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4464.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #51	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4480.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #52	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4499.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #53	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4468.2	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #54	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4493.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #55	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4470.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #56	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4428.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #57	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4509.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #58	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4486.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #59	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O	4470.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4477.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4439.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4509.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #62	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4437.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4401.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #64	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4465.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #65	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4436.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #66	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4477.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #67	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4443.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #68	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4495.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #69	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4458.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4482.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #70	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4490.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #71	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4463.1	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #72	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4488.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #73	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4456.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #74	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4418.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #75	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4455.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #76	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O	4529.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #77	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O	4505.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #78	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4532.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #79	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4497.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4487.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #80	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4476.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #81	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4477.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #82	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4454.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #83	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4500.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #84	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4450.0	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #85	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4422.4	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #86	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4473.6	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #87	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4443.7	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #88	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4465.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #89	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=C1O	4476.3	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4470.9	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #90	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=C1O	4460.8	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #91	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	4479.5	Semi standard non polar	33892256
Diospyrin,3TMS,isomer #92	C[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4535.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4305.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4275.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #100	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4332.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #101	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=C1O	4267.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #102	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=C1O	4270.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #103	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	4259.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #104	C[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4379.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #105	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4373.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #106	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4369.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #107	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4299.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #108	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4273.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #109	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4363.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4259.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #110	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4242.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #111	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4226.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #112	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4290.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #113	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4244.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #114	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)O2	4302.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #115	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4280.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #116	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4375.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #117	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4296.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #118	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4242.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #119	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4296.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4290.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #120	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4243.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #121	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4289.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #122	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4273.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #123	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4286.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #124	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4234.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #125	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4222.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #126	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4215.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #127	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4279.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #128	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4258.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #129	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4324.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4359.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #130	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4341.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #131	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4321.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #132	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4262.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #133	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4313.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #134	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4302.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #135	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4251.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #136	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4289.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #137	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O	4331.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #138	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O	4333.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #139	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4325.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4379.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #140	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O	4280.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #141	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O	4281.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #142	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4274.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #143	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4410.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #144	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4348.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #145	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4301.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #146	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4287.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #147	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4307.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #148	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4290.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #149	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4339.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4363.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #150	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4294.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #151	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4278.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #152	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4288.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #153	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4317.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #154	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	4316.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4389.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4357.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4345.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4371.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4287.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4371.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4389.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4388.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4300.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O	4255.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4360.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4341.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4371.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4303.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4276.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4323.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4293.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4269.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4317.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4252.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4220.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4272.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4355.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4370.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4365.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4320.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4314.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4291.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4329.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4298.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4343.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4285.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4248.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4299.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4389.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4399.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4397.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4309.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4319.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4308.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4283.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4326.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4278.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4263.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4303.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4329.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #58	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4343.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4339.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4294.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4298.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4314.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4311.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #63	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4424.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #64	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4381.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #65	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4337.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #66	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4359.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #67	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4296.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #68	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4259.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #69	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4366.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4325.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #70	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4359.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #71	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O	4314.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #72	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4259.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #73	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4358.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #74	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4259.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #75	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4207.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #76	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4301.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #77	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4243.6	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #78	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4302.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #79	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4280.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4270.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #80	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4313.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #81	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4288.8	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #82	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O[Si](C)(C)C	4332.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #83	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4281.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #84	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4324.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #85	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O[Si](C)(C)C	4274.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #86	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4234.7	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #87	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4261.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #88	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4386.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #89	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4378.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4265.1	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #90	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4377.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #91	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4316.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #92	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4312.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #93	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4308.9	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #94	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4289.5	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #95	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4306.0	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #96	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4253.2	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #97	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4242.4	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #98	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4295.3	Semi standard non polar	33892256
Diospyrin,4TMS,isomer #99	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4272.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4156.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4110.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #100	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4117.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #101	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)O2	4167.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #102	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4156.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #103	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4267.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #104	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O	4155.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #105	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4112.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #106	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O	4152.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #107	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4108.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #108	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O	4170.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #109	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O)=C1O[Si](C)(C)C	4153.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4157.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #110	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4134.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #111	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4099.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #112	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4097.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #113	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4084.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #114	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4142.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #115	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4127.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #116	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4173.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #117	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C	4200.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #118	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O[Si](C)(C)C	4205.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #119	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4139.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4134.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #120	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4177.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #121	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O[Si](C)(C)C	4181.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #122	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4125.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #123	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4157.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #124	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4187.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #125	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4181.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #126	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4170.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #127	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O[Si](C)(C)C	4144.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #128	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4145.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #129	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4135.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4182.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #130	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O[Si](C)(C)C	4290.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #131	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4211.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #132	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4165.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #133	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4148.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #134	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4161.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #135	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4145.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #136	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4189.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #137	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4150.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #138	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4131.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #139	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4129.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4140.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #140	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4165.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #141	C[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	4166.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #142	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4251.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #143	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4168.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #144	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4146.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #145	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4166.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #146	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4149.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #147	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)O2	4209.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #148	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4195.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #149	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4149.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4203.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #150	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4133.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #151	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)O2	4148.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #152	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4140.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #153	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)O2	4170.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #154	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4150.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #155	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	4221.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #156	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4170.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #157	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4130.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #158	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4146.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #159	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4131.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4154.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #160	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4142.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #161	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4128.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #162	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4190.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #163	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4128.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #164	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4110.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #165	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4119.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #166	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4160.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #167	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C2O	4226.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #168	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C2O	4159.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #169	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C2O	4194.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4108.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #170	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O	4187.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #171	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O	4182.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #172	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4170.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #173	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C2O	4173.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #174	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C2O	4167.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #175	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4153.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #176	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4209.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #177	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C2O	4173.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #178	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4187.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #179	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4169.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4178.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #180	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4182.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #181	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4177.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #182	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4157.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4190.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4147.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4212.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4219.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4096.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4126.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4110.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4146.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4100.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4075.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4123.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4150.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4125.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4169.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4173.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4237.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4188.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4253.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4268.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4289.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4293.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4244.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4268.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4155.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4271.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4337.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4151.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4132.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4154.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4122.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4179.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O	4118.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O	4114.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C	4149.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4124.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4222.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4242.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4249.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4139.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4130.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4094.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4157.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4105.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #58	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4080.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4132.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4178.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4141.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4162.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4169.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #63	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4103.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #64	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4122.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4125.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4280.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O	4167.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4169.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #69	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4136.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4128.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #70	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4192.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #71	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4143.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #72	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4120.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #73	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4169.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #74	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4181.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4201.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #76	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4206.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #77	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4145.9	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #78	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4162.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #79	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4166.5	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2O[Si](C)(C)C)C(O)C(O)C1O	4108.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #80	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4316.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #81	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O	4152.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #82	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O	4129.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #83	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C	4181.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #84	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4159.4	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #85	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4175.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #86	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4187.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #87	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4141.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #88	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4160.8	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #89	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4164.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4133.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #90	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4248.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #91	C[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4207.1	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #92	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4233.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #93	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4230.6	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #94	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4187.3	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #95	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4155.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #96	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	4209.2	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #97	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4113.7	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #98	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1)O2	4097.0	Semi standard non polar	33892256
Diospyrin,5TMS,isomer #99	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1)O2	4157.2	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	4860.7	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O)C1O	4893.0	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	4908.0	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	4925.8	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	4920.8	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)C=C1O	4952.7	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)OC(CO)C(O)C1O	4922.7	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C1O	4933.7	Semi standard non polar	33892256
Diospyrin,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C1O	4943.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5013.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C(C)(C)C	5062.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	5046.2	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)C=C1O	5061.4	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5037.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5035.6	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5024.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5045.2	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5050.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5034.5	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	5029.6	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	5023.4	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	5038.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5041.0	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	5064.7	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	5066.4	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C2O	5076.3	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C2O	5056.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C2O	5054.2	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(O)=C1O	5053.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	5045.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	5035.4	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	5044.2	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5049.9	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5038.9	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C=C1O	5058.7	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C=C1O	5042.7	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C=C1O	5040.3	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5036.7	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1C(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	5059.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5061.6	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O	5039.8	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C(O)C1O	5044.1	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5026.3	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5042.5	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5036.7	Semi standard non polar	33892256
Diospyrin,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5055.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5085.9	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C(O)C1O	5069.7	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5071.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5071.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5087.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O	5108.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C(O)C1O	5089.9	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5100.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5095.7	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5113.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O	5106.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5085.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O	5086.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5065.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5072.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5082.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5048.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5062.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5072.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	5087.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	5097.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	5096.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5116.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5127.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5103.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5076.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	5083.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O	5108.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C(C)(C)C)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5103.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C(C)(C)C	5125.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O[Si](C)(C)C(C)(C)C	5114.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C2O[Si](C)(C)C(C)(C)C	5120.9	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C2O[Si](C)(C)C(C)(C)C	5092.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5100.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C	5098.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(O)=C1O	5068.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	5044.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	5048.7	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5106.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5095.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C=C1O	5057.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C=C1O	5037.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O[Si](C)(C)C(C)(C)C)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C=C1O	5035.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	5055.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5076.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	5058.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)OC1C2=C(O)C=C(O)C=C2OC(C2=CC(O)=C(O)C(O)=C2)C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	5057.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5117.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5077.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	5084.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)O2	5109.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C(C)(C)C)=C1)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5105.9	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O)C(C1=CC(O)=C(O)C(O)=C1)O2	5071.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	5072.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(O)=C1O	5085.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5071.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5066.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #61	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O)C(O)=C1)O2	5069.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #62	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	5053.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #63	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5042.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #64	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	5061.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #65	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)O2	5046.7	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #66	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5105.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #67	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5089.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #68	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	5134.7	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #69	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O)C2O	5115.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5081.0	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #70	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C2O	5115.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #71	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C2O	5080.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #72	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C2O	5091.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #73	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C2O	5093.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #74	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C2O	5069.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #75	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C2O	5075.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #76	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O)C2O	5103.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #77	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C)C2O	5103.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #78	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC(O)=C(O)C(O)=C1)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)C2O	5102.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #79	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	5059.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O	5101.2	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #80	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	5062.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #81	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5099.1	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #82	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5081.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #83	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	5060.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #84	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5065.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #85	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5048.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #86	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C1O	5072.8	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #87	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O[Si](C)(C)C(C)(C)C	5054.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #88	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C	5117.3	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #89	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C=C1O	5049.5	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C(O)C1O	5087.4	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #90	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C=C1O	5051.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #91	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2OC3=CC(O)=CC(O)=C3C(O)C2OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C1O	5053.6	Semi standard non polar	33892256
Diospyrin,3TBDMS,isomer #92	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	5092.9	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (Non-derivatized) - 70eV, Positive	splash10-0gir-7703900000-b49eb85d4860123a959a	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (2 TMS) - 70eV, Positive	splash10-03dr-5930027000-473f13e8431d22f9dde9	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_2_15) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_36) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_37) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_38) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_39) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_40) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_49) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_50) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_3_51) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_80) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_81) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_82) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_83) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_84) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_85) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_86) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Diospyrin GC-MS (TMS_4_87) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 10V, Positive-QTOF	splash10-05g0-0309600000-970d7171e9e7827c5461	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 20V, Positive-QTOF	splash10-05fr-0908100000-e5834e30d1672e1ad193	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 40V, Positive-QTOF	splash10-0pbi-0912000000-e1e45679615b206ef415	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 10V, Negative-QTOF	splash10-0089-1406900000-6104832fb29a36fdd3a5	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 20V, Negative-QTOF	splash10-0fk9-1709200000-8800343860fc705a15bd	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 40V, Negative-QTOF	splash10-00b9-3902000000-0c2e3ac89db62c456d4e	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 10V, Positive-QTOF	splash10-05fr-0009000000-7a1a34ed69d41125b3db	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 20V, Positive-QTOF	splash10-05fs-0809000000-280cae67ef64b7bc7c60	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 40V, Positive-QTOF	splash10-0ac9-4903100000-411f6aef05c7e6832245	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 10V, Negative-QTOF	splash10-001i-0000900000-a28e5ff9a90d95a45cfa	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 20V, Negative-QTOF	splash10-107i-1509700000-d035205e3c2772b4e9d4	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Diospyrin 40V, Negative-QTOF	splash10-0udi-0924000000-75a4eb5b7529bba3dd58	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

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

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

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

FDB018308

KNApSAcK ID

C00009020

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

74977207

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Diospyrin (HMDB0038867)

MOL for HMDB0038867 (Diospyrin)

3D MOL for HMDB0038867 (Diospyrin)

3D SDF for HMDB0038867 (Diospyrin)

3D-SDF for HMDB0038867 (Diospyrin)

PDB for HMDB0038867 (Diospyrin)

3D PDB for HMDB0038867 (Diospyrin)

SMILES for HMDB0038867 (Diospyrin)

INCHI for HMDB0038867 (Diospyrin)

Structure for HMDB0038867 (Diospyrin)

3D Structure for HMDB0038867 (Diospyrin)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra