Glycoside
GD136302
Name:
Judaicin 7-O-GlucosideFormula:
C23H24O10Smiles:
COc1cc2c(cc1C1=Cc3ccc(OC4OC(CO)C(O)C(O)C4O)cc3OC1)OCO2Aglycone:
COc1cc2c(cc1C1=Cc3ccc(O)cc3OC1)OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 460.44 | Num_heavy_atoms: | 33 |
| TPSA: | 136.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD48997
Formula: C17H14O5
Smiles:
COc1cc2c(cc1C1=Cc3ccc(O)cc3OC1)OCO2| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 3.06 | Num_rotatable_bonds: | 2 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 57.15 | NumAromaticRings: | 2 |
