Glycoside
GD138745
Name:
1-(3,5-dimethoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)propan-1-oneFormula:
C17H24O9Smiles:
CCC(=O)c1cc(OC)c(OC2OC(CO)C(O)C(O)C2O)c(OC)c1Aglycone:
CCC(=O)c1cc(OC)c(O)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 7 |
| MolWt: | 372.37 | Num_heavy_atoms: | 26 |
| TPSA: | 134.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD23122
Formula: C11H14O4
Smiles:
CCC(=O)c1cc(OC)c(O)c(OC)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 210.23 | Num_heavy_atoms: | 15 |
| TPSA: | 55.76 | NumAromaticRings: | 1 |
