Glycoside
GD089038
Name:
NoneFormula:
C21H29O9NSmiles:
COC(=O)[C@H]1C[C@H](N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)C[C@H]1C(=O)OCc1ccccc1Aglycone:
COC(=O)C1CC(N)CC1C(=O)OCc1ccccc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 11 |
| MolWt: | 439.46 | Num_heavy_atoms: | 31 |
| TPSA: | 162.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD38910
Formula: C15H19O4N
Smiles:
COC(=O)C1CC(N)CC1C(=O)OCc1ccccc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.32 | Num_heavy_atoms: | 20 |
| TPSA: | 78.62 | NumAromaticRings: | 1 |
