Glycoside
GD126674
Name:
4,5-bis(benzoyloxy)oxan-2-yl benzoateFormula:
C26H22O7Smiles:
O=C(OC1CC(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)CO1)c1ccccc1Aglycone:
O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1Sugarmoiety:
OC1CC(O)C(O)CO1Other Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.19 |
| AlogP: | 4.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.46 | Num_heavy_atoms: | 33 |
| TPSA: | 88.13 | NumAromaticRings: | 3 |
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 |
