Glycoside
GD034367
Name:
NoneFormula:
C18H18O7NClSmiles:
O=C1Cc2ccc(Cl)cc2C=C1C(=O)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(=O)C1=Cc2cc(Cl)ccc2CC1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 3 |
| MolWt: | 383.78 | Num_heavy_atoms: | 26 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD21856
Formula: C12H8O2NCl
Smiles:
NC(=O)C1=Cc2cc(Cl)ccc2CC1=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 221.64 | Num_heavy_atoms: | 15 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
