Glycoside
GD040491
Name:
(1s)-2,3,6-tri-o-acetyl-1,5-anhydro-1-sulfamoyl-d-glucitolFormula:
C12H19O10NSSmiles:
CC(=O)OC[C@H]1O[C@H](S(N)(=O)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OAglycone:
COC(C)=OSugarmoiety:
CC(=O)OC1C(O)C(O)OC(S(N)(=O)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.75 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 369.35 | Num_heavy_atoms: | 24 |
| TPSA: | 168.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
