Glycoside
GD120840
Name:
2-[(2,4-dimethoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methylidene]-4,5,6-trihydroxy-7-methoxy-2,3-dihydro-1-benzofuran-3-oneFormula:
C24H26O14Smiles:
COc1ccc(C=C2Oc3c(OC)c(O)c(O)c(O)c3C2=O)c(OC)c1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1ccc(C=C2Oc3c(OC)c(O)c(O)c(O)c3C2=O)c(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 7 |
| MolWt: | 538.46 | Num_heavy_atoms: | 38 |
| TPSA: | 214.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD48588
Formula: C18H16O9
Smiles:
COc1ccc(C=C2Oc3c(OC)c(O)c(O)c(O)c3C2=O)c(OC)c1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.17 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.32 | Num_heavy_atoms: | 27 |
| TPSA: | 134.91 | NumAromaticRings: | 2 |
