Glycoside
GD028480
Name:
NoneFormula:
C24H25O7ClSmiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCO3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1c(Cc2ccc(C3CC3)cc2)ccc2c1OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 448.9 | Num_heavy_atoms: | 31 |
| TPSA: | 108.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD18595
Formula: C18H15O2Cl
Smiles:
Clc1c(Cc2ccc(C3CC3)cc2)ccc2c1OCO2| HBA: | 2 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 4.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 286.76 | Num_heavy_atoms: | 20 |
| TPSA: | 18.46 | NumAromaticRings: | 2 |
