Glycoside
GD046789
Name:
2,3,4,5,6-pentahydroxyhexyl 2-chlorobenzoateFormula:
C14H17O7ClSmiles:
O=C(OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1ccccc1ClAglycone:
O=Cc1ccccc1ClSugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 320.73 | Num_heavy_atoms: | 21 |
| TPSA: | 127.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD25413
Formula: C8H5OCl
Smiles:
O=Cc1ccccc1Cl| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 140.57 | Num_heavy_atoms: | 9 |
| TPSA: | 17.07 | NumAromaticRings: | 1 |
