Glycoside
GD140538
Name:
2-{5-[2-(3,4-dihydroxyphenyl)ethenyl]-2-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C20H22O9Smiles:
OCC1OC(Oc2cc(C=Cc3ccc(O)c(O)c3)ccc2O)C(O)C(O)C1OAglycone:
Oc1ccc(C=Cc2ccc(O)c(O)c2)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.3 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.39 | Num_heavy_atoms: | 29 |
| TPSA: | 160.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD56662
Formula: C14H12O4
Smiles:
Oc1ccc(C=Cc2ccc(O)c(O)c2)cc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.25 | Num_heavy_atoms: | 18 |
| TPSA: | 80.92 | NumAromaticRings: | 2 |
