Glycoside
GD030915
Name:
NoneFormula:
C22H26O7N2Smiles:
CC(=O)Nc1cccc(-c2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)c1Aglycone:
CC(=O)Nc1cccc(-c2ccccc2O)c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 430.46 | Num_heavy_atoms: | 31 |
| TPSA: | 137.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD19983
Formula: C14H13O2N
Smiles:
CC(=O)Nc1cccc(-c2ccccc2O)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.26 | Num_heavy_atoms: | 17 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
