Glycoside
GD039667
Name:
5-deoxy-5-{[(1s)-1-hydroxyethyl]amino}-d-glucitolFormula:
C8H19O6NSmiles:
CC(O)N[C@H](CO)[C@@H](O)[C@@H](O)[C@@H](O)COAglycone:
CC(O)NCCOSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 0 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -3.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 225.24 | Num_heavy_atoms: | 15 |
| TPSA: | 133.41 | NumAromaticRings: | 0 |
Unique Aglycone
AD24499
Formula: C4H11O2N
Smiles:
CC(O)NCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 105.14 | Num_heavy_atoms: | 7 |
| TPSA: | 52.49 | NumAromaticRings: | 0 |
