Glycoside
GD033853
Name:
NoneFormula:
C24H24O5NClSmiles:
Cc1cc2c3c([nH]c2cc1Cl)C(C)(C)c1cc(OC[C@H](O)[C@H](O)CO)ccc1C3=OAglycone:
Cc1cc2c3c([nH]c2cc1Cl)C(C)(C)c1ccccc1C3=OSugarmoiety:
OCC(O)C(O)COOOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 3.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 429.9 | Num_heavy_atoms: | 30 |
| TPSA: | 102.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD21581
Formula: C20H16ONCl
Smiles:
Cc1cc2c3c([nH]c2cc1Cl)C(C)(C)c1ccccc1C3=O| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 309.8 | Num_heavy_atoms: | 22 |
| TPSA: | 32.86 | NumAromaticRings: | 3 |
