Glycoside
GD077240
Name:
2-{6-amino-8-[2-(phenylmethylidene)hydrazin-1-yl]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C17H19O4N7Smiles:
Nc1ncnc2c1nc(N/N=C/c1ccccc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
Nc1ncnc2c1N=C(NN=Cc1ccccc1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 385.38 | Num_heavy_atoms: | 28 |
| TPSA: | 163.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD35466
Formula: C12H10N7
Smiles:
Nc1ncnc2c1N=C(NN=Cc1ccccc1)[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 252.26 | Num_heavy_atoms: | 19 |
| TPSA: | 102.65 | NumAromaticRings: | 2 |
