Glycoside
GD023883
Name:
NoneFormula:
C22H23O7ClSmiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc(O)cc3)c(Cl)c3c2CCO3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc(Cc2ccc3c(c2Cl)OCC3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 422.86 | Num_heavy_atoms: | 29 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD16014
Formula: C16H13O2Cl
Smiles:
Oc1ccc(Cc2ccc3c(c2Cl)OCC3)cc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 3.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 260.72 | Num_heavy_atoms: | 18 |
| TPSA: | 29.46 | NumAromaticRings: | 2 |
