Glycoside
GD134831
Name:
butyl 3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]butanoateFormula:
C19H34O12Smiles:
CCCCOC(=O)CC(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1OAglycone:
CCCCOC(=O)CC(C)OSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.95 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 10 |
| MolWt: | 454.47 | Num_heavy_atoms: | 31 |
| TPSA: | 184.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD54539
Formula: C8H16O3
Smiles:
CCCCOC(=O)CC(C)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 160.21 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
