Glycoside
GD117974
Name:
methyl 2,4,5-tris(acetyloxy)-6-[1,2,3-tris(acetyloxy)propyl]oxane-2-carboxylateFormula:
C22H30O15Smiles:
COC(=O)C1(OC(C)=O)CC(OC(C)=O)C(OC(C)=O)C(C(OC(C)=O)C(COC(C)=O)OC(C)=O)O1Aglycone:
CC(=O)OCC(COC(C)=O)OC(C)=OSugarmoiety:
COC(=O)C1(OC(C)=O)CC(OC(C)=O)C(OC(C)=O)C(O)O1Other Identifiers
Properties
| HBA: | 15 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.68 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 10 |
| MolWt: | 534.47 | Num_heavy_atoms: | 37 |
| TPSA: | 193.33 | NumAromaticRings: | 0 |
Unique Aglycone
AD43987
Formula: C9H14O6
Smiles:
CC(=O)OCC(COC(C)=O)OC(C)=O| HBA: | 6 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 218.2 | Num_heavy_atoms: | 15 |
| TPSA: | 78.9 | NumAromaticRings: | 0 |
