Glycoside
GD020308
Name:
2-[6-(hydroxyamino)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C10H13O5N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NO)ncnc32)[C@H](O)[C@H]1OAglycone:
ONc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 283.24 | Num_heavy_atoms: | 20 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD13793
Formula: C5H4ON5
Smiles:
ONc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
