Glycoside
GD146988
Name:
[4,5-bis(acetyloxy)-3-hydroxy-6-methoxyoxan-2-yl]methyl acetateFormula:
C13H20O9Smiles:
COC1OC(COC(C)=O)C(O)C(OC(C)=O)C1OC(C)=OAglycone:
COC(C)=OSugarmoiety:
COC1OC(O)C(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.77 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.29 | Num_heavy_atoms: | 22 |
| TPSA: | 117.59 | 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 |
