Glycoside
GD021648
Name:
9-(3,4,5-trihydroxyoxan-2-yl)-6,9-dihydro-1H-purin-6-oneFormula:
C10H12O5N4Smiles:
Oc1ncnc2c1ncn2C1OCC(O)C(O)C1OAglycone:
Oc1ncnc2c1N=C[N]2Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 1 |
| MolWt: | 268.23 | Num_heavy_atoms: | 19 |
| TPSA: | 133.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD00956
Formula: C5H3ON4
Smiles:
Oc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.11 | Num_heavy_atoms: | 10 |
| TPSA: | 72.47 | NumAromaticRings: | 1 |
