Glycoside
GD092894
Name:
2-[6-amino-8-(2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}hydrazin-1-yl)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C20H23O5N7Smiles:
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1Aglycone:
C=CCOc1ccc(C=NNC2=Nc3c(N)ncnc3[N]2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.3 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 441.45 | Num_heavy_atoms: | 32 |
| TPSA: | 173.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD40370
Formula: C15H14ON7
Smiles:
C=CCOc1ccc(C=NNC2=Nc3c(N)ncnc3[N]2)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 308.32 | Num_heavy_atoms: | 23 |
| TPSA: | 111.88 | NumAromaticRings: | 2 |
