Glycoside
GD137460
Name:
2-[4-(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl]oxy}ethyl)-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H34O11Smiles:
COc1cc(C=CCOCCc2cc(OC)c(OC3OC(CO)C(O)C(O)C3O)c(OC)c2)ccc1OAglycone:
COc1cc(C=CCOCCc2cc(OC)c(O)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 12 |
| MolWt: | 522.55 | Num_heavy_atoms: | 37 |
| TPSA: | 156.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD55530
Formula: C20H24O6
Smiles:
COc1cc(C=CCOCCc2cc(OC)c(O)c(OC)c2)ccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 3.4 | Num_rotatable_bonds: | 9 |
| MolWt: | 360.41 | Num_heavy_atoms: | 26 |
| TPSA: | 77.38 | NumAromaticRings: | 2 |
