Glycoside
GD030827
Name:
NoneFormula:
C15H18O7N2Smiles:
COc1ccc(-c2noc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)n2)cc1Aglycone:
COc1ccc(-c2ncon2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 4 |
| MolWt: | 338.32 | Num_heavy_atoms: | 24 |
| TPSA: | 138.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD19935
Formula: C9H8O2N2
Smiles:
COc1ccc(-c2ncon2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.18 | Num_heavy_atoms: | 13 |
| TPSA: | 48.15 | NumAromaticRings: | 2 |
