Glycoside
GD092291
Name:
NoneFormula:
C21H28O7NClSmiles:
COC(=O)[C@]1(c2ccc(Cl)cc2)CC[C@H](N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CC1Aglycone:
COC(=O)C1(c2ccc(Cl)cc2)CCC(N)CC1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 9 |
| MolWt: | 429.9 | Num_heavy_atoms: | 29 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD40269
Formula: C15H18O2NCl
Smiles:
COC(=O)C1(c2ccc(Cl)cc2)CCC(N)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 267.76 | Num_heavy_atoms: | 18 |
| TPSA: | 52.32 | NumAromaticRings: | 1 |
