SG6
Summary
| Name: | 4-O-acetyl-6-O-sulfamoyl-alpha-D-galactopyranose |
| Synonyms: | 4-O-acetyl-6-O-sulfamoyl-alpha-D-galactose 4-O-acetyl-6-O-sulfamoyl-D-galactose; 4-O-acetyl-6-O-sulfamoyl-galactose |
| Formula: | C8 H15 N O9 S |
| Formal charge: | 0 |
| Formula weight: | 301.271 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-O-acetyl-6-O-sulfamoyl-alpha-D-galactopyranose |
| OpenEye OEToolkits | 1.7.2 | [(2R,3R,4R,5R,6S)-4,5,6-tris(oxidanyl)-2-(sulfamoyloxymethyl)oxan-3-yl] ethanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(OCC1OC(O)C(O)C(O)C1OC(=O)C)N |
| InChI | InChI | 1.03 | InChI=1S/C8H15NO9S/c1-3(10)17-7-4(2-16-19(9,14)15)18-8(13)6(12)5(7)11/h4-8,11-13H,2H2,1H3,(H2,9,14,15)/t4-,5-,6-,7+,8+/m1/s1 |
| InChIKey | InChI | 1.03 | FXBYYANFSLVRSY-YQXRAVKXSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=O)O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1CO[S](N)(=O)=O |
| SMILES | CACTVS | 3.370 | CC(=O)O[CH]1[CH](O)[CH](O)[CH](O)O[CH]1CO[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CC(=O)O[C@H]1[C@H](O[C@@H]([C@@H]([C@H]1O)O)O)COS(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | CC(=O)OC1C(OC(C(C1O)O)O)COS(=O)(=O)N |
