Glycoside
GD058567
Name:
NoneFormula:
C14H21O8NSmiles:
C=C[C@@H]1C[C@]1(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C(=O)OCCAglycone:
C=CC1CC1(N)C(=O)OCCSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.75 | Num_rotatable_bonds: | 9 |
| MolWt: | 331.32 | Num_heavy_atoms: | 23 |
| TPSA: | 153.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD29260
Formula: C8H13O2N
Smiles:
C=CC1CC1(N)C(=O)OCC| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 155.2 | Num_heavy_atoms: | 11 |
| TPSA: | 52.32 | NumAromaticRings: | 0 |
