Glycoside
GD008800
Name:
EGONOL GLUCOSIDEFormula:
C25H28O10Smiles:
COc1cc(CCCO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc2cc(-c3ccc4c(c3)OCO4)oc12Aglycone:
COc1cc(CCCO)cc2cc(-c3ccc4c(c3)OCO4)oc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 8 |
| MolWt: | 488.49 | Num_heavy_atoms: | 35 |
| TPSA: | 140.21 | NumAromaticRings: | 3 |
Unique Aglycone
AD00502
Formula: C19H18O5
Smiles:
COc1cc(CCCO)cc2cc(-c3ccc4c(c3)OCO4)oc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.26 |
| AlogP: | 3.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.35 | Num_heavy_atoms: | 24 |
| TPSA: | 61.06 | NumAromaticRings: | 3 |
