Glycoside
GD144732
Name:
2-[4-(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl]oxy}ethyl)-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C25H32O10Smiles:
COc1cc(C=CCOCCc2ccc(OC3OC(CO)C(O)C(O)C3O)c(OC)c2)ccc1OAglycone:
COc1cc(C=CCOCCc2ccc(O)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 11 |
| MolWt: | 492.52 | Num_heavy_atoms: | 35 |
| TPSA: | 147.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD58137
Formula: C19H22O5
Smiles:
COc1cc(C=CCOCCc2ccc(O)c(OC)c2)ccc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.26 |
| AlogP: | 3.39 | Num_rotatable_bonds: | 8 |
| MolWt: | 330.38 | Num_heavy_atoms: | 24 |
| TPSA: | 68.15 | NumAromaticRings: | 2 |
