Glycoside
GD148240
Name:
6-{[4-(acetyloxy)-3-hydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-4,5-bis(hexanoyloxy)-2-(hydroxymethyl)oxan-3-yl hexanoateFormula:
C32H54O15Smiles:
CCCCCC(=O)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(C)=O)C2O)C(OC(=O)CCCCC)C1OC(=O)CCCCCAglycone:
CCCCCC(=O)O.CCCCCC(=O)O.CCCCCC(=O)OSugarmoiety:
CC(=O)OC1C(CO)OC(CO)(OC2OC(CO)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 21 |
| MolWt: | 678.77 | Num_heavy_atoms: | 47 |
| TPSA: | 213.81 | NumAromaticRings: | 0 |
Unique Aglycone
AD00130
Formula: C6H12O2
Smiles:
CCCCCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
