Glycoside
GD124803
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl)oxy]oxane-3,4,5-triolFormula:
C21H36O11Smiles:
C=CC(C)(O)CCC=C(C)COC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC=C(C)COSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.81 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 11 |
| MolWt: | 464.51 | Num_heavy_atoms: | 32 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD13647
Formula: C10H18O2
Smiles:
C=CC(C)(O)CCC=C(C)CO| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 170.25 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
