Glycoside
GD120733
Name:
2-{6-[(4-hydroxy-3-methylbutyl)amino]-9H-purin-9-yl}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H25O6N5Smiles:
CC(CO)CCNc1ncnc2c1ncn2C1OC(CO)C(O)C(O)C1OAglycone:
CC(CO)CCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 383.41 | Num_heavy_atoms: | 27 |
| TPSA: | 166.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD19347
Formula: C10H14ON5
Smiles:
CC(CO)CCNc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 220.26 | Num_heavy_atoms: | 16 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
