Glycoside
GD152258
Name:
2,3,4-trihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)butan-1-oneFormula:
C12H16O7Smiles:
COc1cc(C(=O)C(O)C(O)CO)cc(OC)c1OAglycone:
COc1cccc(OC)c1OSugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 6 |
| MolWt: | 272.25 | Num_heavy_atoms: | 19 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD25431
Formula: C8H10O3
Smiles:
COc1cccc(OC)c1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 2 |
| MolWt: | 154.16 | Num_heavy_atoms: | 11 |
| TPSA: | 38.69 | NumAromaticRings: | 1 |
