Glycoside
GD007115
Name:
NoneFormula:
C25H29O6ClSmiles:
COCC1(c2ccc(Cc3cc([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc3Cl)cc2)CC1Aglycone:
COCC1(c2ccc(Cc3ccccc3Cl)cc2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 448.94 | Num_heavy_atoms: | 31 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD05815
Formula: C19H19OCl
Smiles:
COCC1(c2ccc(Cc3ccccc3Cl)cc2)CC1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 4.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 286.8 | Num_heavy_atoms: | 20 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
