Glycoside
GD149791
Name:
3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl 4-methylpent-4-enoateFormula:
C17H28O11Smiles:
C=C(C)CCC(=O)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1OAglycone:
C=C(C)CCC(=O)OSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.82 |
| AlogP: | -2.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 408.4 | Num_heavy_atoms: | 28 |
| TPSA: | 175.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD59881
Formula: C6H10O2
Smiles:
C=C(C)CCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 114.14 | Num_heavy_atoms: | 8 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
