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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (230) Show 230 proteins XML

Record Information

Version

5.0

Status

Detected and Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2021-09-14 15:48:15 UTC

HMDB ID

HMDB0001201

Secondary Accession Numbers

HMDB01201

Metabolite Identification

Common Name

Guanosine diphosphate

Description

Guanosine diphosphate, also known as 5'-GDP or 5'-diphosphate, guanosine, belongs to the class of organic compounds known as purine ribonucleoside diphosphates. These are purine ribobucleotides with diphosphate group linked to the ribose moiety. Guanosine diphosphate exists in all living species, ranging from bacteria to humans. In humans, guanosine diphosphate is involved in intracellular signalling through adenosine receptor A2B and adenosine. Outside of the human body, Guanosine diphosphate has been detected, but not quantified in several different foods, such as devilfish, java plums, green beans, almonds, and orange mints. Guanosine diphosphate is a purine ribonucleoside 5'-diphosphate resulting from the formal condensation of the hydroxy group at the 5' position of guanosine with pyrophosphoric acid.

Structure

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


  Mrv1652308122017292D          

 28 30  0  0  1  0            999 V2000
   -0.1676   -6.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5800   -6.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6574   -6.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0699   -6.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4225   -5.4654    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.9124   -5.4654    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9642   -4.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3767   -5.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0440   -5.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7092   -5.2519    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7892   -4.4673    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4629   -6.5574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7978   -5.5876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4546   -5.0777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2165   -6.8930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3076   -7.7388    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8840   -6.4081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2449   -4.9805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6498   -5.2521    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0627   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9335   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2370   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2194   -5.2519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7947   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0804   -5.2521    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4933   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3641   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6676   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 18  5  1  0  0  0  0
 18  6  1  0  0  0  0
  5  1  1  0  0  0  0
  1  3  1  0  0  0  0
  3  6  1  0  0  0  0
  1  2  1  6  0  0  0
  3  4  1  6  0  0  0
  6 10  1  1  0  0  0
 11  7  2  0  0  0  0
 11  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10  8  1  0  0  0  0
  8 12  1  0  0  0  0
  9  8  2  0  0  0  0
  9 13  1  0  0  0  0
 12 15  2  0  0  0  0
 15 17  1  0  0  0  0
 17 13  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 21 23  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 25 28  1  0  0  0  0
 27 19  1  0  0  0  0
  5 23  1  1  0  0  0
M  END

HMDB0001201
     RDKit          3D
Guanosine diphosphate
 43 45  0  0  0  0  0  0  0  0999 V2000
   -5.9998   -1.0235    2.0027 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4455   -0.2140    0.9632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1192   -0.1077    0.8760 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4923    0.6361   -0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2859    1.3029   -0.9800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4450    1.9548   -1.8017 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1822    1.6957   -1.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2006    0.8820   -0.3460 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1112    0.3279    0.4235 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1266    0.7055   -0.0332 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9717   -0.3964    0.1566 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2512   -0.2615   -0.6153 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8912    0.8949   -0.1636 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3540    1.1576   -0.9624 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.8757    2.5109   -0.5403 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1648    1.1856   -2.6421 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5166    0.0055   -0.5607 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4313    0.5266    0.7376 P   0  0  0  0  0  5  0  0  0  0  0  0
    6.0459    1.9299    1.1931 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0988    0.4758    0.4080 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1764   -0.4929    2.0771 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0988   -1.5217   -0.3613 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5744   -2.7665    0.0397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2010   -1.1769    0.3356 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1584   -1.6896    1.6252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6536    1.1682   -0.8574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3693    1.7809   -1.6890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2294    0.4262    0.0928 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7348   -1.7294    1.8160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6597   -0.9049    2.9752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2890    2.0717   -1.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2397    0.6733    1.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1835   -0.5973    1.2130 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1270   -0.2965   -1.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9040   -1.1095   -0.3219 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8839    0.7204   -3.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2635   -0.3165   -0.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9070   -1.3793    1.6906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0314   -1.4510   -1.4667 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4370   -3.4269   -0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0847   -1.5152   -0.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0773   -0.9694    2.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2733    0.3140    0.1988 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 14 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 18 21  1  0
 11 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
  5 26  1  0
 26 27  2  0
 26 28  1  0
 28  2  1  0
  8  4  1  0
 24  9  1  0
  1 29  1  0
  1 30  1  0
  7 31  1  0
  9 32  1  1
 11 33  1  1
 12 34  1  0
 12 35  1  0
 16 36  1  0
 20 37  1  0
 21 38  1  0
 22 39  1  6
 23 40  1  0
 24 41  1  6
 25 42  1  0
 28 43  1  0
M  END


  Mrv1652308122017292D          

 28 30  0  0  1  0            999 V2000
   -0.1676   -6.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5800   -6.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6574   -6.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0699   -6.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4225   -5.4654    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.9124   -5.4654    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9642   -4.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3767   -5.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0440   -5.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7092   -5.2519    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7892   -4.4673    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4629   -6.5574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7978   -5.5876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4546   -5.0777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2165   -6.8930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3076   -7.7388    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8840   -6.4081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2449   -4.9805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6498   -5.2521    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0627   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9335   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2370   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2194   -5.2519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7947   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0804   -5.2521    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4933   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3641   -5.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6676   -4.5337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 18  5  1  0  0  0  0
 18  6  1  0  0  0  0
  5  1  1  0  0  0  0
  1  3  1  0  0  0  0
  3  6  1  0  0  0  0
  1  2  1  6  0  0  0
  3  4  1  6  0  0  0
  6 10  1  1  0  0  0
 11  7  2  0  0  0  0
 11  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10  8  1  0  0  0  0
  8 12  1  0  0  0  0
  9  8  2  0  0  0  0
  9 13  1  0  0  0  0
 12 15  2  0  0  0  0
 15 17  1  0  0  0  0
 17 13  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 21 23  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 25 28  1  0  0  0  0
 27 19  1  0  0  0  0
  5 23  1  1  0  0  0
M  END
> <DATABASE_ID>
HMDB0001201

> <DATABASE_NAME>
hmdb

> <SMILES>
NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1

> <INCHI_IDENTIFIER>
InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1

> <INCHI_KEY>
QGWNDRXFNXRZMB-UUOKFMHZSA-N

> <FORMULA>
C10H15N5O11P2

> <MOLECULAR_WEIGHT>
443.2005

> <EXACT_MASS>
443.024329371

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_ATOM_COUNT>
43

> <JCHEM_AVERAGE_POLARIZABILITY>
34.739486370128645

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid

> <ALOGPS_LOGP>
-1.51

> <JCHEM_LOGP>
-3.7243866562591625

> <ALOGPS_LOGS>
-2.00

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-3

> <JCHEM_PKA>
3.3024767112356916

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.7094768764485213

> <JCHEM_PKA_STRONGEST_BASIC>
2.553880812380109

> <JCHEM_POLAR_SURFACE_AREA>
248.28

> <JCHEM_REFRACTIVITY>
85.93349999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.44e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0001201
     RDKit          3D
Guanosine diphosphate
 43 45  0  0  0  0  0  0  0  0999 V2000
   -5.9998   -1.0235    2.0027 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4455   -0.2140    0.9632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1192   -0.1077    0.8760 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4923    0.6361   -0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2859    1.3029   -0.9800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4450    1.9548   -1.8017 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1822    1.6957   -1.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2006    0.8820   -0.3460 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1112    0.3279    0.4235 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1266    0.7055   -0.0332 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9717   -0.3964    0.1566 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2512   -0.2615   -0.6153 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8912    0.8949   -0.1636 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3540    1.1576   -0.9624 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.8757    2.5109   -0.5403 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1648    1.1856   -2.6421 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5166    0.0055   -0.5607 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4313    0.5266    0.7376 P   0  0  0  0  0  5  0  0  0  0  0  0
    6.0459    1.9299    1.1931 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0988    0.4758    0.4080 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1764   -0.4929    2.0771 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0988   -1.5217   -0.3613 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5744   -2.7665    0.0397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2010   -1.1769    0.3356 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1584   -1.6896    1.6252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6536    1.1682   -0.8574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3693    1.7809   -1.6890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2294    0.4262    0.0928 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7348   -1.7294    1.8160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6597   -0.9049    2.9752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2890    2.0717   -1.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2397    0.6733    1.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1835   -0.5973    1.2130 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1270   -0.2965   -1.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9040   -1.1095   -0.3219 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8839    0.7204   -3.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2635   -0.3165   -0.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9070   -1.3793    1.6906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0314   -1.4510   -1.4667 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4370   -3.4269   -0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0847   -1.5152   -0.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0773   -0.9694    2.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2733    0.3140    0.1988 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 14 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 18 21  1  0
 11 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
  5 26  1  0
 26 27  2  0
 26 28  1  0
 28  2  1  0
  8  4  1  0
 24  9  1  0
  1 29  1  0
  1 30  1  0
  7 31  1  0
  9 32  1  1
 11 33  1  1
 12 34  1  0
 12 35  1  0
 16 36  1  0
 20 37  1  0
 21 38  1  0
 22 39  1  6
 23 40  1  0
 24 41  1  6
 25 42  1  0
 28 43  1  0
M  END

HEADER    PROTEIN                                 12-AUG-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   12-AUG-20         0                                  
HETATM    1  C   UNK     0      -0.313 -11.667   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0      -1.083 -13.000   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       1.227 -11.667   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       1.997 -13.000   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      -0.789 -10.202   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.703 -10.202   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.667  -8.339   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.437 -10.709   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       5.682  -9.804   0.000  0.00  0.00           C+0
HETATM   10  N   UNK     0       3.191  -9.804   0.000  0.00  0.00           N+0
HETATM   11  N   UNK     0       5.207  -8.339   0.000  0.00  0.00           N+0
HETATM   12  N   UNK     0       4.597 -12.240   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       7.089 -10.430   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       8.315  -9.478   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       6.004 -12.867   0.000  0.00  0.00           C+0
HETATM   16  N   UNK     0       6.174 -14.446   0.000  0.00  0.00           N+0
HETATM   17  N   UNK     0       7.250 -11.962   0.000  0.00  0.00           N+0
HETATM   18  O   UNK     0       0.457  -9.297   0.000  0.00  0.00           O+0
HETATM   19  P   UNK     0      -4.946  -9.804   0.000  0.00  0.00           P+0
HETATM   20  O   UNK     0      -5.717  -8.463   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -3.609 -10.574   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -4.176  -8.463   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0      -2.276  -9.804   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      -8.950 -10.574   0.000  0.00  0.00           O+0
HETATM   25  P   UNK     0      -7.617  -9.804   0.000  0.00  0.00           P+0
HETATM   26  O   UNK     0      -8.387  -8.463   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      -6.280 -10.574   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      -6.846  -8.463   0.000  0.00  0.00           O+0
CONECT    1    5    3    2                                                  
CONECT    2    1                                                            
CONECT    3    1    6    4                                                  
CONECT    4    3                                                            
CONECT    5   18    1   23                                                  
CONECT    6   18    3   10                                                  
CONECT    7   11   10                                                       
CONECT    8   10   12    9                                                  
CONECT    9   11    8   13                                                  
CONECT   10    6    7    8                                                  
CONECT   11    7    9                                                       
CONECT   12    8   15                                                       
CONECT   13    9   17   14                                                  
CONECT   14   13                                                            
CONECT   15   12   17   16                                                  
CONECT   16   15                                                            
CONECT   17   15   13                                                       
CONECT   18    5    6                                                       
CONECT   19   20   21   22   27                                             
CONECT   20   19                                                            
CONECT   21   19   23                                                       
CONECT   22   19                                                            
CONECT   23   21    5                                                       
CONECT   24   25                                                            
CONECT   25   24   26   27   28                                             
CONECT   26   25                                                            
CONECT   27   25   19                                                       
CONECT   28   25                                                            
MASTER        0    0    0    0    0    0    0    0   28    0   60    0
END

COMPND    HMDB0001201
HETATM    1  N1  UNL     1      -6.000  -1.023   2.003  1.00  0.00           N  
HETATM    2  C1  UNL     1      -5.446  -0.214   0.963  1.00  0.00           C  
HETATM    3  N2  UNL     1      -4.119  -0.108   0.876  1.00  0.00           N  
HETATM    4  C2  UNL     1      -3.492   0.636  -0.074  1.00  0.00           C  
HETATM    5  C3  UNL     1      -4.286   1.303  -0.980  1.00  0.00           C  
HETATM    6  N3  UNL     1      -3.445   1.955  -1.802  1.00  0.00           N  
HETATM    7  C4  UNL     1      -2.182   1.696  -1.412  1.00  0.00           C  
HETATM    8  N4  UNL     1      -2.201   0.882  -0.346  1.00  0.00           N  
HETATM    9  C5  UNL     1      -1.111   0.328   0.424  1.00  0.00           C  
HETATM   10  O1  UNL     1       0.127   0.705  -0.033  1.00  0.00           O  
HETATM   11  C6  UNL     1       0.972  -0.396   0.157  1.00  0.00           C  
HETATM   12  C7  UNL     1       2.251  -0.261  -0.615  1.00  0.00           C  
HETATM   13  O2  UNL     1       2.891   0.895  -0.164  1.00  0.00           O  
HETATM   14  P1  UNL     1       4.354   1.158  -0.962  1.00  0.00           P  
HETATM   15  O3  UNL     1       4.876   2.511  -0.540  1.00  0.00           O  
HETATM   16  O4  UNL     1       4.165   1.186  -2.642  1.00  0.00           O  
HETATM   17  O5  UNL     1       5.517   0.005  -0.561  1.00  0.00           O  
HETATM   18  P2  UNL     1       6.431   0.527   0.738  1.00  0.00           P  
HETATM   19  O6  UNL     1       6.046   1.930   1.193  1.00  0.00           O  
HETATM   20  O7  UNL     1       8.099   0.476   0.408  1.00  0.00           O  
HETATM   21  O8  UNL     1       6.176  -0.493   2.077  1.00  0.00           O  
HETATM   22  C8  UNL     1       0.099  -1.522  -0.361  1.00  0.00           C  
HETATM   23  O9  UNL     1       0.574  -2.766   0.040  1.00  0.00           O  
HETATM   24  C9  UNL     1      -1.201  -1.177   0.336  1.00  0.00           C  
HETATM   25  O10 UNL     1      -1.158  -1.690   1.625  1.00  0.00           O  
HETATM   26  C10 UNL     1      -5.654   1.168  -0.857  1.00  0.00           C  
HETATM   27  O11 UNL     1      -6.369   1.781  -1.689  1.00  0.00           O  
HETATM   28  N5  UNL     1      -6.229   0.426   0.093  1.00  0.00           N  
HETATM   29  H1  UNL     1      -6.735  -1.729   1.816  1.00  0.00           H  
HETATM   30  H2  UNL     1      -5.660  -0.905   2.975  1.00  0.00           H  
HETATM   31  H3  UNL     1      -1.289   2.072  -1.870  1.00  0.00           H  
HETATM   32  H4  UNL     1      -1.240   0.673   1.470  1.00  0.00           H  
HETATM   33  H5  UNL     1       1.183  -0.597   1.213  1.00  0.00           H  
HETATM   34  H6  UNL     1       2.127  -0.296  -1.698  1.00  0.00           H  
HETATM   35  H7  UNL     1       2.904  -1.109  -0.322  1.00  0.00           H  
HETATM   36  H8  UNL     1       4.884   0.720  -3.111  1.00  0.00           H  
HETATM   37  H9  UNL     1       8.263  -0.316  -0.163  1.00  0.00           H  
HETATM   38  H10 UNL     1       5.907  -1.379   1.691  1.00  0.00           H  
HETATM   39  H11 UNL     1      -0.031  -1.451  -1.467  1.00  0.00           H  
HETATM   40  H12 UNL     1       0.437  -3.427  -0.693  1.00  0.00           H  
HETATM   41  H13 UNL     1      -2.085  -1.515  -0.238  1.00  0.00           H  
HETATM   42  H14 UNL     1      -1.077  -0.969   2.306  1.00  0.00           H  
HETATM   43  H15 UNL     1      -7.273   0.314   0.199  1.00  0.00           H  
CONECT    1    2   29   30
CONECT    2    3    3   28
CONECT    3    4
CONECT    4    5    5    8
CONECT    5    6   26
CONECT    6    7    7
CONECT    7    8   31
CONECT    8    9
CONECT    9   10   24   32
CONECT   10   11
CONECT   11   12   22   33
CONECT   12   13   34   35
CONECT   13   14
CONECT   14   15   15   16   17
CONECT   16   36
CONECT   17   18
CONECT   18   19   19   20   21
CONECT   20   37
CONECT   21   38
CONECT   22   23   24   39
CONECT   23   40
CONECT   24   25   41
CONECT   25   42
CONECT   26   27   27   28
CONECT   28   43
END

HMDB0001201
     RDKit          3D
Guanosine diphosphate
 43 45  0  0  0  0  0  0  0  0999 V2000
   -5.9998   -1.0235    2.0027 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4455   -0.2140    0.9632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1192   -0.1077    0.8760 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4923    0.6361   -0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2859    1.3029   -0.9800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4450    1.9548   -1.8017 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1822    1.6957   -1.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2006    0.8820   -0.3460 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1112    0.3279    0.4235 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1266    0.7055   -0.0332 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9717   -0.3964    0.1566 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2512   -0.2615   -0.6153 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8912    0.8949   -0.1636 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3540    1.1576   -0.9624 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.8757    2.5109   -0.5403 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1648    1.1856   -2.6421 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5166    0.0055   -0.5607 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4313    0.5266    0.7376 P   0  0  0  0  0  5  0  0  0  0  0  0
    6.0459    1.9299    1.1931 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0988    0.4758    0.4080 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1764   -0.4929    2.0771 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0988   -1.5217   -0.3613 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5744   -2.7665    0.0397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2010   -1.1769    0.3356 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1584   -1.6896    1.6252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6536    1.1682   -0.8574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3693    1.7809   -1.6890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2294    0.4262    0.0928 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7348   -1.7294    1.8160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6597   -0.9049    2.9752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2890    2.0717   -1.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2397    0.6733    1.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1835   -0.5973    1.2130 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1270   -0.2965   -1.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9040   -1.1095   -0.3219 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8839    0.7204   -3.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2635   -0.3165   -0.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9070   -1.3793    1.6906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0314   -1.4510   -1.4667 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4370   -3.4269   -0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0847   -1.5152   -0.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0773   -0.9694    2.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2733    0.3140    0.1988 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 14 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 18 21  1  0
 11 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
  5 26  1  0
 26 27  2  0
 26 28  1  0
 28  2  1  0
  8  4  1  0
 24  9  1  0
  1 29  1  0
  1 30  1  0
  7 31  1  0
  9 32  1  1
 11 33  1  1
 12 34  1  0
 12 35  1  0
 16 36  1  0
 20 37  1  0
 21 38  1  0
 22 39  1  6
 23 40  1  0
 24 41  1  6
 25 42  1  0
 28 43  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Guanosine 5'-diphosphate	ChEBI
Guanosine 5'-diphosphoric acid	Generator
Guanosine diphosphoric acid	Generator
5'-GDP	HMDB
GDP	HMDB
Guanosine 5'-(trihydrogen pyrophosphate)	HMDB
Guanosine 5'-pyrophosphate	HMDB
Guanosine mono(trihydrogen diphosphate)	HMDB
Guanosine pyrophosphate	HMDB
Guanosine-5'-diphosphate	HMDB
Guanosine-diphosphate	HMDB
PpG	HMDB
5'-Diphosphate, guanosine	HMDB
Diphosphate, guanosine 5'-trihydrogen	HMDB
Guanosine 5' diphosphate	HMDB
Guanosine 5' trihydrogen diphosphate	HMDB
5'-Trihydrogen diphosphate, guanosine	HMDB
Diphosphate, guanosine	HMDB
Guanosine 5'-trihydrogen diphosphate	HMDB

Chemical Formula

C₁₀H₁₅N₅O₁₁P₂

Average Molecular Weight

443.2005

Monoisotopic Molecular Weight

443.024329371

IUPAC Name

[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid

Traditional Name

{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxyphosphonic acid

CAS Registry Number

146-91-8

SMILES

NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1

InChI Identifier

InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1

InChI Key

QGWNDRXFNXRZMB-UUOKFMHZSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as purine ribonucleoside diphosphates. These are purine ribobucleotides with diphosphate group linked to the ribose moiety.

Kingdom

Organic compounds

Super Class

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Sub Class

Purine ribonucleotides

Direct Parent

Purine ribonucleoside diphosphates

Alternative Parents

Substituents

Purine ribonucleoside diphosphate
Purine ribonucleoside monophosphate
Pentose phosphate
Pentose-5-phosphate
Glycosyl compound
N-glycosyl compound
6-oxopurine
Hypoxanthine
Monosaccharide phosphate
Organic pyrophosphate
Pentose monosaccharide
Imidazopyrimidine
Purine
Aminopyrimidine
Monoalkyl phosphate
Pyrimidone
Monosaccharide
N-substituted imidazole
Organic phosphoric acid derivative
Alkyl phosphate
Phosphoric acid ester
Pyrimidine
Vinylogous amide
Tetrahydrofuran
Azole
Imidazole
Heteroaromatic compound
Secondary alcohol
1,2-diol
Organoheterocyclic compound
Azacycle
Oxacycle
Organooxygen compound
Organic nitrogen compound
Hydrocarbon derivative
Organic oxide
Organopnictogen compound
Alcohol
Amine
Organic oxygen compound
Primary amine
Organonitrogen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

purine ribonucleoside 5'-diphosphate (CHEBI:17552 )
guanosine 5'-phosphate (CHEBI:17552 )
Ribonucleotides (C00035 )

Ontology

Not Available

Non-excretory biofluid

Blood (HMDB: HMDB0001201)
Cerebrospinal Fluid (CSF) (PMID: 15993662)

Cellular substructure

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

Bovine

Swine

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

Venison

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

Equine

Horse (FooDB: FOOD00378)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Caprae

Domestic goat (FooDB: FOOD00529)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Herbs and Spices (FooDB: FOOD00866)

Vegetable

Cabbage

Onion-family vegetable

Allium (FooDB: FOOD00005)
Garden onion (FooDB: FOOD00006)
Leek (FooDB: FOOD00007)
Garden onion (var.) (FooDB: FOOD00226)
Shallot (FooDB: FOOD00243)
Wild leek (FooDB: FOOD00396)
Red onion (FooDB: FOOD00962)
Green onion (FooDB: FOOD00963)
Onion-family vegetables (FooDB: FOOD00855)

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Lambsquarters (FooDB: FOOD00394)
Jute (FooDB: FOOD00389)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)
Rocket salad (FooDB: FOOD00244)
Green vegetables (FooDB: FOOD00872)

Fruit vegetable

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

Tuber

Stalk vegetable

Other vegetable

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

Mushroom

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

Brassica

Brassicas (FooDB: FOOD00857)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Pummelo (FooDB: FOOD00055)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)
Citrus (FooDB: FOOD00859)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Redcurrant (FooDB: FOOD00156)
Blackcurrant (FooDB: FOOD00155)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Bilberry (FooDB: FOOD00193)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Cascade huckleberry (FooDB: FOOD00220)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)
Rubus (Blackberry, Raspberry) (FooDB: FOOD00160)

Other fruit

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

Drupe

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

Fruits (FooDB: FOOD00871)

Nut

Cashew nut (FooDB: FOOD00011)
Peanut (FooDB: FOOD00016)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Colorado pinyon (FooDB: FOOD00433)
Pili nut (FooDB: FOOD00432)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)
Mixed nuts (FooDB: FOOD00771)
Nuts (FooDB: FOOD00869)

Cereal and cereal product

Cereal

Dough

Sourdough (FooDB: FOOD00275)

Raisin bread (FooDB: FOOD00817)

Other bread

Potato bread (FooDB: FOOD00811)
Other bread (FooDB: FOOD00269)

Cereals and cereal products (FooDB: FOOD00858)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

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

Bean

Green lentil (FooDB: FOOD00970)
Pulses (FooDB: FOOD00867)

Gourd

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

Coffee and coffee product

Coffee

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

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Dish

Other dish

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

Tea

Herbal tea

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

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Abalone (FooDB: FOOD00279)
Conch (FooDB: FOOD00611)

Cocoa and cocoa product

Cocoa

Cocoa bean (FooDB: FOOD00182)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Purine Metabolism (HMDB: HMDB0001201)
Gluconeogenesis (HMDB: HMDB0001201)
Citric Acid Cycle (HMDB: HMDB0001201)
Aspartate Metabolism (PathBank: SMP0000067)
Pyruvate Metabolism (PathBank: SMP0000060)
Warburg Effect (PathBank: SMP0000654)
Purine Nucleotides De Novo Biosynthesis (PathBank: SMP0000927)
Purine Nucleotides De Novo Biosynthesis 2 (PathBank: SMP0002047)
TCA Cycle (PathBank: SMP0002304)
Mannose Metabolism (PathBank: SMP0002315)
Purine Nucleotides De Novo Biosynthesis (PathBank: SMP0002377)
N-Glycan Biosynthesis (PathBank: SMP0002400)
TCA Cycle (PathBank: SMP0002414)
Ascorbate Metabolism (PathBank: SMP0012446)
Citrate Cycle (PathBank: SMP0121182)

Disease pathway

Adenosine Deaminase Deficiency (PathBank: SMP0000144)
Adenylosuccinate Lyase Deficiency (PathBank: SMP0000167)
Gout or Kelley-Seegmiller Syndrome (PathBank: SMP0000365)
Lesch-Nyhan Syndrome (LNS) (PathBank: SMP0000364)
Molybdenum Cofactor Deficiency (PathBank: SMP0000203)
Xanthine Dehydrogenase Deficiency (Xanthinuria) (PathBank: SMP0000220)
Purine Nucleoside Phosphorylase Deficiency (PathBank: SMP0000210)
AICA-Ribosiduria (PathBank: SMP0000168)
Canavan Disease (PathBank: SMP0000175)
Hypoacetylaspartia (PathBank: SMP0000192)
Leigh Syndrome (PathBank: SMP0000196)
Pyruvate Decarboxylase E1 Component Deficiency (PDHE1 Deficiency) (PathBank: SMP0000334)
Pyruvate Dehydrogenase Complex Deficiency (PathBank: SMP0000212)
Glycogen Storage Disease Type 1A (GSD1A) or Von Gierke Disease (PathBank: SMP0000374)
Xanthinuria Type I (PathBank: SMP0000512)
Xanthinuria Type II (PathBank: SMP0000513)
Adenine Phosphoribosyltransferase Deficiency (APRT) (PathBank: SMP0000535)
Mitochondrial DNA Depletion Syndrome (PathBank: SMP0000536)
Myoadenylate Deaminase Deficiency (PathBank: SMP0000537)
Congenital Lactic Acidosis (PathBank: SMP0000546)
Fumarase Deficiency (PathBank: SMP0000547)
Mitochondrial Complex II Deficiency (PathBank: SMP0000548)
2-Ketoglutarate Dehydrogenase Complex Deficiency (PathBank: SMP0000549)
Pyruvate Dehydrogenase Deficiency (E3) (PathBank: SMP0000550)
Pyruvate Dehydrogenase Deficiency (E2) (PathBank: SMP0000551)
Primary Hyperoxaluria II, PH2 (PathBank: SMP0000558)
Pyruvate Kinase Deficiency (PathBank: SMP0000559)
Phosphoenolpyruvate Carboxykinase Deficiency 1 (PEPCK1) (PathBank: SMP0000560)
Fructose-1,6-diphosphatase Deficiency (PathBank: SMP0000562)
Triosephosphate Isomerase (PathBank: SMP0000563)
Glycogenosis, Type IB (PathBank: SMP0000573)
Glycogenosis, Type IC (PathBank: SMP0000574)
Glycogenosis, Type IA. Von Gierke Disease (PathBank: SMP0000581)
The Oncogenic Action of 2-Hydroxyglutarate (PathBank: SMP0002291)
The Oncogenic Action of Succinate (PathBank: SMP0002292)
The Oncogenic Action of Fumarate (PathBank: SMP0002295)
Glutaminolysis and Cancer (PathBank: SMP0002298)
The Oncogenic Action of L-2-Hydroxyglutarate in Hydroxygluaricaciduria (PathBank: SMP0002358)
The Oncogenic Action of D-2-Hydroxyglutarate in Hydroxygluaricaciduria (PathBank: SMP0002359)
Mitochondrial DNA Depletion Syndrome (PathBank: SMP0120601)

Drug action pathway

Azathioprine Action Pathway (PathBank: SMP0000427)
Mercaptopurine Action Pathway (PathBank: SMP0000428)
Candesartan Action Pathway (PathBank: SMP0000158)
Eprosartan Action Pathway (PathBank: SMP0000159)
Irbesartan Action Pathway (PathBank: SMP0000161)
Losartan Action Pathway (PathBank: SMP0000162)
Olmesartan Action Pathway (PathBank: SMP0000163)
Telmisartan Action Pathway (PathBank: SMP0000164)
Valsartan Action Pathway (PathBank: SMP0000165)
Thioguanine Action Pathway (PathBank: SMP0000430)
Chlorphenamine H1-Antihistamine Action (PathBank: SMP0056661)
Pheniramine H1-Antihistamine Action (PathBank: SMP0056662)
Dexchlorpheniramine H1-Antihistamine Action (PathBank: SMP0056811)
Brompheniramine H1-Antihistamine Action (PathBank: SMP0057579)
Dexbrompheniramine H1-Antihistamine Action (PathBank: SMP0057580)
Triprolidine H1-Antihistamine Action (PathBank: SMP0057581)
Dimetindene H1-Antihistamine Action (PathBank: SMP0057582)
Mepyramine H1-Antihistamine Action (PathBank: SMP0057583)
Antazoline H1-Antihistamine Action (PathBank: SMP0057584)
Chloropyramine H1-Antihistamine Action (PathBank: SMP0057585)
Talastine H1-Antihistamine Action (PathBank: SMP0057586)
Tripelennamine H1-Antihistamine Action (PathBank: SMP0057587)
Histapyrrodine H1-Antihistamine Action (PathBank: SMP0058732)
Methapyrilene H1-Antihistamine Action (PathBank: SMP0058741)
Thonzylamine H1-Antihistamine Action (PathBank: SMP0058769)
Diphenhydramine H1-Antihistamine Action (PathBank: SMP0058785)
Carbinoxamine H1-Antihistamine Action (PathBank: SMP0058797)
Doxylamine H1-Antihistamine Action (PathBank: SMP0058803)
Orphenadrine H1-Antihistamine Action (PathBank: SMP0058808)
Bromodiphenhydramine H1-Antihistamine Action (PathBank: SMP0058813)
Clemastine H1-Antihistamine Action (PathBank: SMP0058891)
Chlorphenoxamine H1-Antihistamine Action (PathBank: SMP0058903)
Diphenylpyraline H1-Antihistamine Action (PathBank: SMP0058908)
Phenyltoloxamine H1-Antihistamine Action (PathBank: SMP0058916)
Cyclizine H1-Antihistamine Action (PathBank: SMP0058923)
Chlorcyclizine H1-Antihistamine Action (PathBank: SMP0058931)
Hydroxyzine H1-Antihistamine Action (PathBank: SMP0058936)
Meclizine H1-Antihistamine Action (PathBank: SMP0058956)
Buclizine H1-Antihistamine Action (PathBank: SMP0058964)
Oxatomide H1-Antihistamine Action (PathBank: SMP0059044)
Cetirizine H1-Antihistamine Action (PathBank: SMP0059058)
Cinnarizine H1-Antihistamine Action (PathBank: SMP0059110)
Levocetirizine H1-Antihistamine Action (PathBank: SMP0059114)
Promethazine H1-Antihistamine Action (PathBank: SMP0059211)
Alimemazine H1-Antihistamine Action (PathBank: SMP0059689)
Cyproheptadine H1-Antihistamine Action (PathBank: SMP0059694)
Phenbenzamine H1-Antihistamine Action (PathBank: SMP0059702)
Fenethazine H1-Antihistamine Action (PathBank: SMP0059707)
Hydroxyethylpromethazine H1-Antihistamine Action (PathBank: SMP0059710)
Isothipendyl H1-Antihistamine Action (PathBank: SMP0059716)
Mequitazine H1-Antihistamine Action (PathBank: SMP0059720)
Methdilazine H1-Antihistamine Action (PathBank: SMP0059730)
Oxomemazine H1-Antihistamine Action (PathBank: SMP0059738)
Azatadine H1-Antihistamine Action (PathBank: SMP0059865)
Ketotifen H1-Antihistamine Action (PathBank: SMP0059868)
Doxepin H1-Antihistamine Action (PathBank: SMP0059872)
Acrivastine H1-Antihistamine Action (PathBank: SMP0059881)
Astemizole H1-Antihistamine Action (PathBank: SMP0059897)
Bepotastine H1-Antihistamine Action (PathBank: SMP0060058)
Bilastine H1-Antihistamine Action (PathBank: SMP0060170)
Loratadine H1-Antihistamine Action (PathBank: SMP0060195)
Desloratadine H1-Antihistamine Action (PathBank: SMP0060201)
Ebastine H1-Antihistamine Action (PathBank: SMP0060204)
Terfenadine H1-Antihistamine Action (PathBank: SMP0060208)
Fexofenadine H1-Antihistamine Action (PathBank: SMP0060218)
Levocabastine H1-Antihistamine Action (PathBank: SMP0060224)
Mizolastine H1-Antihistamine Action (PathBank: SMP0060230)
Rupatadine H1-Antihistamine Action (PathBank: SMP0060235)
Olopatadine H1-Antihistamine Action (PathBank: SMP0060740)
Azelastine H1-Antihistamine Action (PathBank: SMP0060741)
Thiazinamium H1-Antihistamine Action (PathBank: SMP0060742)
Quifenadine H1-Antihistamine Action (PathBank: SMP0060743)
Betahistine H1-Antihistamine Action (PathBank: SMP0060744)
Emedastine H1-Antihistamine Action (PathBank: SMP0061040)
Flunarizine H1-Antihistamine Action (PathBank: SMP0061047)
Mebhydrolin H1-Antihistamine Action (PathBank: SMP0061052)
Phenindamine H1-Antihistamine Action (PathBank: SMP0061190)
Epinastine H1-Antihistamine Action (PathBank: SMP0061191)
Tolpropamine H1-Antihistamine Action (PathBank: SMP0062621)
Embramine H1-Antihistamine Action (PathBank: SMP0062622)
Latrepirdine H1-Antihistamine Action (PathBank: SMP0062623)
Thenyldiamine H1-Antihistamine Action (PathBank: SMP0062624)
Propiomazine H1-Antihistamine Action (PathBank: SMP0062625)
Clocinizine H1-Antihistamine Action (PathBank: SMP0062788)
Homochlorcyclizine H1-Antihistamine Action (PathBank: SMP0062795)
Temelastine H1-Antihistamine Action (PathBank: SMP0062880)
Alcaftadine H1-Antihistamine Action (PathBank: SMP0062881)
Bamipine H1-Antihistamine Action (PathBank: SMP0062882)
Deptropine H1-Antihistamine Action (PathBank: SMP0062883)
Quetiapine H1-Antihistamine Action (PathBank: SMP0062884)
Mirtazapine H1-Antihistamine Action (PathBank: SMP0062885)
Pimethixene H1-Antihistamine Action (PathBank: SMP0062886)
Pyrrobutamine H1-Antihistamine Action (PathBank: SMP0062887)
Thenalidine H1-Antihistamine Action (PathBank: SMP0062894)
Tritoqualine H1-Antihistamine Action (PathBank: SMP0062895)

Signaling pathway

Dopamine Activation of Neurological Reward System (PathBank: SMP0000308)
Intracellular Signalling Through Histamine H2 Receptor and Histamine (PathBank: SMP0000335)
Intracellular Signalling Through PGD2 receptor and Prostaglandin D2 (PathBank: SMP0000343)
Intracellular Signalling Through Prostacyclin Receptor and Prostacyclin (PathBank: SMP0000354)
Activation of PKC Through G Protein-Coupled Receptor (PathBank: SMP0000749)
Histamine H1 Receptor Activation (PathBank: SMP0063452)
Rac 1 cell motility signaling pathway (PathBank: SMP0100469)

Protein pathway

Excitatory Neural Signalling Through 5-HTR 4 and Serotonin (PathBank: SMP0000309)
Corticotropin Activation of Cortisol Production (PathBank: SMP0000310)
Excitatory Neural Signalling Through 5-HTR 7 and Serotonin (PathBank: SMP0000311)
Excitatory Neural Signalling Through 5-HTR 6 and Serotonin (PathBank: SMP0000312)
Intracellular Signalling Through Adenosine Receptor A2a and Adenosine (PathBank: SMP0000320)
Intracellular Signalling Through Adenosine Receptor A2b and Adenosine (PathBank: SMP0000321)
Vasopressin Regulation of Water Homeostasis (PathBank: SMP0000322)
Intracellular Signalling Through FSH Receptor and Follicle Stimulating Hormone (PathBank: SMP0000333)
Intracellular Signalling Through LHCGR Receptor and Luteinizing Hormone/Choriogonadotropin (PathBank: SMP0000338)
Insulin Signalling (PathBank: SMP0000391)
Lysophosphatidic Acid LPA1 Signalling (PathBank: SMP0063746)
Lysophosphatidic Acid LPA2 Signalling (PathBank: SMP0063753)
Lysophosphatidic Acid LPA3 Signalling (PathBank: SMP0063755)
Lysophosphatidic Acid LPA4 Signalling (PathBank: SMP0063756)
Lysophosphatidic Acid LPA5 Signalling (PathBank: SMP0063757)
Lysophosphatidic Acid LPA6 Signalling (PathBank: SMP0063759)
Activation of cAMP-dependent protein kinase, PKA (PathBank: SMP0063764)
Rac 1 Cell Motility Signaling Pathway (PathBank: SMP0063795)
Cadmium Induces DNA Synthesis and Proliferation in Macrophages (PathBank: SMP0063805)
EGF Signalling Pathway (PathBank: SMP0063810)
EPO Signaling Pathway (PathBank: SMP0069678)
BCR Signaling Pathway (PathBank: SMP0069871)

Physiological pathway

Pancreas Function - Beta Cell (PathBank: SMP0121018)
Aldosterone from Steroidogenesis (PathBank: SMP0121126)

Role

Industrial application

Pharmaceutical industry

Biomarker

Subarachnoid hemorrhage (MarkerDB: MDB00000308)

Physical Properties

State

Solid

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Experimental Collision Cross Sections

Adduct Type	Data Source	CCS Value (Å²)	Reference
[M-H]-	Not Available	182.5	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000161
[M+H]+	Not Available	192.1	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000161

Predicted Molecular Properties

Property	Value	Source
Water Solubility	4.44 g/L	ALOGPS
logP	-1.5	ALOGPS
logP	-3.7	ChemAxon
logS	-2	ALOGPS
pKa (Strongest Acidic)	1.71	ChemAxon
pKa (Strongest Basic)	2.55	ChemAxon
Physiological Charge	-3	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	248.28 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	85.93 m³·mol⁻¹	ChemAxon
Polarizability	34.74 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	197.396	31661259
DarkChem	[M-H]-	187.643	31661259
AllCCS	[M+H]+	189.304	32859911
AllCCS	[M-H]-	182.038	32859911
DeepCCS	[M+H]+	174.499	30932474
DeepCCS	[M-H]-	172.337	30932474
DeepCCS	[M-2H]-	206.21	30932474
DeepCCS	[M+Na]+	181.816	30932474
AllCCS	[M+H]+	189.3	32859911
AllCCS	[M+H-H2O]+	187.1	32859911
AllCCS	[M+NH4]+	191.4	32859911
AllCCS	[M+Na]+	192.0	32859911
AllCCS	[M-H]-	182.0	32859911
AllCCS	[M+Na-2H]-	182.0	32859911
AllCCS	[M+HCOO]-	182.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Guanosine diphosphate	NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1	4264.4	Standard polar	33892256
Guanosine diphosphate	NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1	2391.6	Standard non polar	33892256
Guanosine diphosphate	NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1	4212.2	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Guanosine diphosphate,1TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3662.2	Semi standard non polar	33892256
Guanosine diphosphate,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3653.7	Semi standard non polar	33892256
Guanosine diphosphate,1TMS,isomer #3	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3725.0	Semi standard non polar	33892256
Guanosine diphosphate,1TMS,isomer #4	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O	3716.8	Semi standard non polar	33892256
Guanosine diphosphate,1TMS,isomer #5	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)[NH]1	3651.4	Semi standard non polar	33892256
Guanosine diphosphate,1TMS,isomer #6	C[Si](C)(C)N1C(N)=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C1=O	3663.4	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3521.6	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #10	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3626.8	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #11	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)[NH]1	3617.6	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #12	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3658.5	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #13	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O	3630.7	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3598.0	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #15	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	3653.4	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #16	C[Si](C)(C)N(C1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)[NH]1)[Si](C)(C)C	3606.8	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3640.2	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3585.5	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3579.0	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #4	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3531.5	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3582.0	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3572.4	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3571.6	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #8	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3531.5	Semi standard non polar	33892256
Guanosine diphosphate,2TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3576.7	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3460.1	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3512.2	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	5911.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3542.2	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3506.3	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	6064.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3495.0	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3702.0	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	5962.4	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #12	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3547.6	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #12	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3601.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #12	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	6041.1	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3492.9	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3565.0	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	5699.6	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3492.1	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3630.5	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5775.0	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3525.0	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3546.9	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	6096.4	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3496.3	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3547.5	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	5752.6	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3492.0	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3618.0	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5810.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3534.7	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3531.1	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	6092.3	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3491.4	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3722.1	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	5984.0	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3471.0	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3500.9	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	5907.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3547.1	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3625.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	6062.0	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3551.5	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3597.3	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #21	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5535.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #22	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3545.8	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #22	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3662.5	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #22	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	5562.5	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3592.8	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3582.1	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #23	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	5912.4	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3557.0	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3770.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #24	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	5741.6	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #25	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3612.9	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #25	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3674.5	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #25	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	5831.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #26	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3553.2	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #26	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3652.8	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #26	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	5602.1	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	3593.5	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	3571.9	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #27	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	5968.3	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	3549.7	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	3763.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #28	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	5785.7	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3612.4	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3664.6	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	5867.9	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #3	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3456.3	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #3	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3560.8	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #3	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	6020.0	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #30	C[Si](C)(C)N(C1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C)[Si](C)(C)C	3637.7	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #30	C[Si](C)(C)N(C1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C)[Si](C)(C)C	3781.7	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #30	C[Si](C)(C)N(C1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C)[Si](C)(C)C	6092.2	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3494.5	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3494.2	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	6282.3	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3506.1	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3536.6	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	5671.6	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #6	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3493.3	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #6	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3600.7	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #6	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	5743.8	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3534.7	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3519.8	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	6070.3	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3508.3	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3520.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	5724.0	Standard polar	33892256
Guanosine diphosphate,3TMS,isomer #9	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3486.1	Semi standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #9	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3590.4	Standard non polar	33892256
Guanosine diphosphate,3TMS,isomer #9	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	5788.9	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3447.9	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3429.8	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	5530.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #10	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3491.6	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #10	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3515.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #10	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	5261.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3534.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3433.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	5661.1	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3509.6	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3665.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	5388.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #13	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3543.2	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #13	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3534.6	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #13	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	5491.5	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3495.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	3501.8	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #14	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)[NH]1	5283.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3537.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	3419.3	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O	5694.8	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3495.5	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	3654.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #16	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O	5454.0	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3537.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	3526.2	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #17	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O)C(=O)N1[Si](C)(C)C	5547.2	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@@H]1O	3547.2	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@@H]1O	3676.4	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #18	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@@H]1O	5710.5	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3471.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	3456.6	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #19	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)[NH]C2=O	5319.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #2	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3456.3	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #2	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3519.3	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #2	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5491.0	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3485.3	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3548.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #20	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5294.7	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3523.7	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3460.1	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #21	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	5689.5	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3499.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3691.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #22	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	5422.8	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #23	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3541.7	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #23	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3563.3	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #23	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	5524.4	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #24	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3487.9	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #24	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3533.7	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #24	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5306.4	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3527.4	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	3444.2	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #25	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O	5722.2	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3489.6	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	3679.2	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #26	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O	5476.1	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #27	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3539.3	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #27	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3553.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #27	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	5569.0	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O	3541.0	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O	3696.1	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O	5731.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3542.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	3566.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #29	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)[NH]1	5063.1	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3484.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3432.9	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	5902.7	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #30	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3570.5	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #30	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3472.2	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #30	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	5512.1	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3551.7	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	3709.9	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #31	C[Si](C)(C)OP(=O)(O)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O)O[Si](C)(C)C	5236.9	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #32	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3592.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #32	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3579.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #32	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	5335.2	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3604.7	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	3730.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #33	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O)OP(=O)(O)O	5501.8	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	3555.3	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	3705.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #34	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@H](O)[C@@H]1O	5245.1	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #35	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3602.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #35	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	3564.8	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #35	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H]2O)C(=O)N1[Si](C)(C)C	5347.8	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	3607.6	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	3725.3	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #36	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)[C@H](O)[C@@H]1O	5549.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3449.3	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3412.6	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #4	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	5558.0	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #5	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3447.2	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #5	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	3508.5	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #5	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)[NH]1	5547.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3494.4	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	3424.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)[C@@H]1O[Si](C)(C)C	5904.8	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3463.5	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3638.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@@H](N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)[C@@H]1O[Si](C)(C)C	5668.3	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #8	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3502.1	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #8	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	3526.9	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #8	C[Si](C)(C)NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C	5761.2	Standard polar	33892256
Guanosine diphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3481.8	Semi standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	3426.0	Standard non polar	33892256
Guanosine diphosphate,4TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O	5288.0	Standard polar	33892256
Guanosine diphosphate,5TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3447.9	Semi standard non polar	33892256
Guanosine diphosphate,5TMS,isomer #1	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H](N2C=NC3=C2N=C(N)[NH]C3=O)[C@@H]1O[Si](C)(C)C	3322.9	Standard non polar	33892256

Showing metabocard for Guanosine diphosphate (HMDB0001201)

MOL for HMDB0001201 (Guanosine diphosphate)

3D MOL for HMDB0001201 (Guanosine diphosphate)

3D SDF for HMDB0001201 (Guanosine diphosphate)

3D-SDF for HMDB0001201 (Guanosine diphosphate)

PDB for HMDB0001201 (Guanosine diphosphate)

3D PDB for HMDB0001201 (Guanosine diphosphate)

SMILES for HMDB0001201 (Guanosine diphosphate)

INCHI for HMDB0001201 (Guanosine diphosphate)

Structure for HMDB0001201 (Guanosine diphosphate)

3D Structure for HMDB0001201 (Guanosine diphosphate)

Experimental Collision Cross Sections

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized