Glycoside
GD042963
Name:
2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzaldehydeFormula:
C13H16O7Smiles:
O=Cc1ccccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1OAglycone:
O=Cc1ccccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.26 | Num_heavy_atoms: | 20 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD05242
Formula: C7H6O2
Smiles:
O=Cc1ccccc1O| 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 |
