Glycoside
GD033475
Name:
NoneFormula:
C20H22O7N2Smiles:
O=C(NC(=O)c1ccc(-c2ccccc2)cc1)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(=O)NC(=O)c1ccc(-c2ccccc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.3 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 402.4 | Num_heavy_atoms: | 29 |
| TPSA: | 148.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD21365
Formula: C14H12O2N2
Smiles:
NC(=O)NC(=O)c1ccc(-c2ccccc2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 240.26 | Num_heavy_atoms: | 18 |
| TPSA: | 72.19 | NumAromaticRings: | 2 |
