Glycoside
GD018595
Name:
NoneFormula:
C11H15O6N3Smiles:
OCc1cc(-c2nc([C@H](O)[C@H](O)[C@H](O)CO)c[nH]2)no1Aglycone:
OCc1cc(-c2ncc[nH]2)no1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 6 |
| MolWt: | 285.26 | Num_heavy_atoms: | 20 |
| TPSA: | 155.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD13090
Formula: C7H7O2N3
Smiles:
OCc1cc(-c2ncc[nH]2)no1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 165.15 | Num_heavy_atoms: | 12 |
| TPSA: | 74.94 | NumAromaticRings: | 2 |
