Glycoside
GD104200
Name:
NoneFormula:
C24H25O10ClSmiles:
CC(C)(Oc1ccc([C@H](O)c2ccc(Cl)cc2)cc1)C(=O)O[C@H]1O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
CC(C)(Oc1ccc(C(O)c2ccc(Cl)cc2)cc1)C(=O)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 496.9 | Num_heavy_atoms: | 34 |
| TPSA: | 162.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD00900
Formula: C18H17O4Cl
Smiles:
CC(C)(Oc1ccc(C(O)c2ccc(Cl)cc2)cc1)C(=O)O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 3.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.77 | Num_heavy_atoms: | 22 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
