Glycoside
GD138422
Name:
2-{6-amino-8-[2-(propan-2-ylidene)hydrazin-1-yl]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C13H19O4N7Smiles:
CC(C)=NNc1nc2c(N)ncnc2n1C1OC(CO)C(O)C1OAglycone:
CC(C)=NNC1=Nc2c(N)ncnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 337.34 | Num_heavy_atoms: | 24 |
| TPSA: | 163.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD55872
Formula: C8H10N7
Smiles:
CC(C)=NNC1=Nc2c(N)ncnc2[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 204.22 | Num_heavy_atoms: | 15 |
| TPSA: | 102.65 | NumAromaticRings: | 1 |
