Glycoside
GD012668
Name:
NoneFormula:
C23H19O6N2ClSmiles:
C[C@@H]1O[C@H](N2C(=O)C(=C3Nc4ccc(Cl)cc4C3=O)c3ccccc32)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C1Nc2ccccc2C1=C1Nc2ccc(Cl)cc2C1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 442.86 | Num_heavy_atoms: | 31 |
| TPSA: | 119.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD09530
Formula: C17H9O2N2Cl
Smiles:
O=C1Nc2ccccc2C1=C1Nc2ccc(Cl)cc2C1=O| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 296.71 | Num_heavy_atoms: | 21 |
| TPSA: | 58.2 | NumAromaticRings: | 2 |
