Glycoside
GD154668
Name:
4-(benzoyloxy)-2-methoxy-5-{[3,4,5-tris(acetyloxy)-6-methyloxan-2-yl]oxy}oxan-3-yl benzoateFormula:
C32H36O14Smiles:
COC1OCC(OC2OC(C)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1Aglycone:
O=C(O)c1ccccc1.O=C(O)c1ccccc1Sugarmoiety:
COC1OCC(OC2OC(C)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.47 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 10 |
| MolWt: | 644.63 | Num_heavy_atoms: | 46 |
| TPSA: | 168.42 | NumAromaticRings: | 2 |
Unique Aglycone
AD00002
Formula: C7H6O2
Smiles:
O=C(O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.12 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
