Glycoside
GD125467
Name:
2-[(4-hydroxypentan-2-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C16H30O11Smiles:
CC(O)CC(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1OAglycone:
CC(O)CC(C)OSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -3.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 398.41 | Num_heavy_atoms: | 27 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD50748
Formula: C5H12O2
Smiles:
CC(O)CC(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 104.15 | Num_heavy_atoms: | 7 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
