Glycoside
GD129015
Name:
[6-acetyl-2,4,5-tris(acetyloxy)-3-hydroxyoxan-2-yl]methyl acetateFormula:
C16H22O11Smiles:
CC(=O)OCC1(OC(C)=O)OC(C(C)=O)C(OC(C)=O)C(OC(C)=O)C1OAglycone:
COC(C)=OSugarmoiety:
CC(=O)OC1C(C(C)=O)OC(O)(OC(C)=O)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.69 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 390.34 | Num_heavy_atoms: | 27 |
| TPSA: | 151.73 | 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 |
