Glycoside
GD083688
Name:
NoneFormula:
C17H16O9NClSmiles:
COC(=O)c1oc2cccc(Cl)c2c1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
COC(=O)c1oc2cccc(Cl)c2c1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 7 |
| MolWt: | 401.76 | Num_heavy_atoms: | 27 |
| TPSA: | 166.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD37310
Formula: C11H8O3NCl
Smiles:
COC(=O)c1oc2cccc(Cl)c2c1N| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 1 |
| MolWt: | 225.63 | Num_heavy_atoms: | 15 |
| TPSA: | 65.46 | NumAromaticRings: | 2 |
