Glycoside
GD034613
Name:
NoneFormula:
C15H18O6NClSmiles:
O=C(Cc1ccc(Cl)cc1)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OAglycone:
NC(=O)Cc1ccc(Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.75 | Num_heavy_atoms: | 22 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD10828
Formula: C9H8ONCl
Smiles:
NC(=O)Cc1ccc(Cl)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 169.61 | Num_heavy_atoms: | 11 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
