Glycoside
GD030657
Name:
2,3,4,5-tetrahydroxy-6-oxohexyl 3,4,5-trihydroxybenzoateFormula:
C13H16O10Smiles:
O=C[C@H](O)[C@H](O)[C@H](O)[C@H](O)COC(=O)c1cc(O)c(O)c(O)c1Aglycone:
O=Cc1cc(O)c(O)c(O)c1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 332.26 | Num_heavy_atoms: | 23 |
| TPSA: | 184.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD02035
Formula: C7H6O4
Smiles:
O=Cc1cc(O)c(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.12 | Num_heavy_atoms: | 11 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
