Glycoside
GD099852
Name:
Cladrastin 7-O-GlucosideFormula:
C24H26O11Smiles:
COc1ccc(-c2coc3cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)c(OC)cc3c2=O)cc1OCAglycone:
COc1cc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 490.46 | Num_heavy_atoms: | 35 |
| TPSA: | 157.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD42304
Formula: C18H16O6
Smiles:
COc1cc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2cc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.32 | Num_heavy_atoms: | 24 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
