Glycoside
GD145884
Name:
1-(2-hydroxy-4,6-dimethoxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-1-oneFormula:
C18H26O10Smiles:
COc1cc(O)c(C(=O)CC(C)OC2OC(CO)C(O)C(O)C2O)c(OC)c1Aglycone:
COc1cc(O)c(C(=O)CC(C)O)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 402.4 | Num_heavy_atoms: | 28 |
| TPSA: | 155.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD58531
Formula: C12H16O5
Smiles:
COc1cc(O)c(C(=O)CC(C)O)c(OC)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 240.25 | Num_heavy_atoms: | 17 |
| TPSA: | 75.99 | NumAromaticRings: | 1 |
