Glycoside
GD016399
Name:
NoneFormula:
C28H29O9NSmiles:
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(-c2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=C(NC(Cc1ccccc1)C(=O)O)c1ccc(-c2ccccc2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 9 |
| MolWt: | 523.54 | Num_heavy_atoms: | 38 |
| TPSA: | 165.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD09883
Formula: C22H19O4N
Smiles:
O=C(NC(Cc1ccccc1)C(=O)O)c1ccc(-c2ccccc2O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.09 |
| AlogP: | 3.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.4 | Num_heavy_atoms: | 27 |
| TPSA: | 86.63 | NumAromaticRings: | 3 |
