Glycoside
GD046987
Name:
2,3,4,5,6-pentahydroxyhexyl 2-aminobenzoateFormula:
C13H19O7NSmiles:
Nc1ccccc1C(=O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ccccc1C=OSugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -2.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 301.3 | Num_heavy_atoms: | 21 |
| TPSA: | 153.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD25400
Formula: C7H7ON
Smiles:
Nc1ccccc1C=O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 121.14 | Num_heavy_atoms: | 9 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
