Glycoside
GD157502
Name:
2-(3-hydroxy-2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl]oxy}propoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H28O10Smiles:
COc1cc(C=CCOC(CO)COC2OC(CO)C(O)C(O)C2O)ccc1OAglycone:
COc1cc(C=CCOC(CO)CO)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.39 | Num_rotatable_bonds: | 10 |
| MolWt: | 416.42 | Num_heavy_atoms: | 29 |
| TPSA: | 158.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD62260
Formula: C13H18O5
Smiles:
COc1cc(C=CCOC(CO)CO)ccc1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 254.28 | Num_heavy_atoms: | 18 |
| TPSA: | 79.15 | NumAromaticRings: | 1 |
