Glycoside
GD132545
Name:
[4,5-bis(acetyloxy)-3,6-dihydroxyoxan-2-yl]methyl acetateFormula:
C12H18O9Smiles:
CC(=O)OCC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OAglycone:
COC(C)=OSugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 306.27 | Num_heavy_atoms: | 21 |
| TPSA: | 128.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
