Glycoside
GD125274
Name:
2,3,4,5-tetrahydroxy-6-oxohexyl 4-hydroxybenzoateFormula:
C13H16O8Smiles:
O=CC(O)C(O)C(O)C(O)COC(=O)c1ccc(O)cc1Aglycone:
O=Cc1ccc(O)cc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 300.26 | Num_heavy_atoms: | 21 |
| TPSA: | 144.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD01669
Formula: C7H6O2
Smiles:
O=Cc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.12 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
