Glycoside
GD129730
Name:
1,3-dibutyl 2-methyl 1,2-dihydroxypropane-1,2,3-tricarboxylateFormula:
C15H26O8Smiles:
CCCCOC(=O)CC(O)(C(=O)OC)C(O)C(=O)OCCCCAglycone:
CCCCOC(C)=OSugarmoiety:
CCCCOC(=O)C(O)C(O)(O)C(=O)OCOther Identifiers
Properties
| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 11 |
| MolWt: | 334.37 | Num_heavy_atoms: | 23 |
| TPSA: | 119.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD52557
Formula: C6H12O2
Smiles:
CCCCOC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
