Glycoside
GD017554
Name:
NoneFormula:
C22H23O10N3Smiles:
CC(=O)Nc1ccc(C(=O)Nc2ccccc2NC(=O)O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CC(=O)Nc1ccc(C(=O)Nc2ccccc2NC(=O)O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.27 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 489.44 | Num_heavy_atoms: | 35 |
| TPSA: | 203.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD12511
Formula: C16H15O4N3
Smiles:
CC(=O)Nc1ccc(C(=O)Nc2ccccc2NC(=O)O)cc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.06 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 313.31 | Num_heavy_atoms: | 23 |
| TPSA: | 107.53 | NumAromaticRings: | 2 |
