Glycoside
GD131403
Name:
2-(4-{3-hydroxy-1-[4-(3-hydroxypropyl)-2-methoxyphenoxy]prop-1-en-1-yl}-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H34O11Smiles:
COc1cc(CCCO)ccc1OC(=CCO)c1ccc(OC2OC(CO)C(O)C(O)C2O)c(OC)c1Aglycone:
COc1cc(C(=CCO)Oc2ccc(CCCO)cc2OC)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 12 |
| MolWt: | 522.55 | Num_heavy_atoms: | 37 |
| TPSA: | 167.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD53237
Formula: C20H24O6
Smiles:
COc1cc(C(=CCO)Oc2ccc(CCCO)cc2OC)ccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 9 |
| MolWt: | 360.41 | Num_heavy_atoms: | 26 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
