Glycoside
GD114307
Name:
4-(acetyloxy)-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoateFormula:
C18H22O10Smiles:
COc1cc(C=CC(=O)OC2C(O)OC(CO)C(O)C2OC(C)=O)ccc1OAglycone:
COc1cc(C=CC(=O)O)ccc1OSugarmoiety:
CC(=O)OC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 6 |
| MolWt: | 398.36 | Num_heavy_atoms: | 28 |
| TPSA: | 151.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD00175
Formula: C10H10O4
Smiles:
COc1cc(C=CC(=O)O)ccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 194.19 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
