Glycoside
GD030928
Name:
2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)-4-methoxyoxolan-3-olFormula:
C11H15O4N5Smiles:
CO[C@@H]1[C@H](CO)O[C@H](n2cnc3c(N)ncnc32)[C@H]1OAglycone:
Nc1ncnc2c1N=C[N]2Sugarmoiety:
COC1C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 281.27 | Num_heavy_atoms: | 20 |
| TPSA: | 128.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
