BXF
Summary
| Name: | 2-deoxy-2-fluoro-beta-D-xylopyranose |
| Synonyms: | 2-deoxy-2-fluoro-beta-D-xylose 2-deoxy-2-fluoro-D-xylose; 2-deoxy-2-fluoro-xylose |
| Formula: | C5 H9 F O4 |
| Formal charge: | 0 |
| Formula weight: | 152.121 Da |
| Component type: | D-saccharide, beta linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-deoxy-2-fluoro-beta-D-xylopyranose |
| OpenEye OEToolkits | 1.7.6 | (2R,3R,4S,5R)-3-fluoranyloxane-2,4,5-triol |
| PDB-CARE | 1.0 | b-D-Xylp2fluoro |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | FC1C(O)C(O)COC1O |
| InChI | InChI | 1.03 | InChI=1S/C5H9FO4/c6-3-4(8)2(7)1-10-5(3)9/h2-5,7-9H,1H2/t2-,3-,4+,5-/m1/s1 |
| InChIKey | InChI | 1.03 | YVMHSZGJGHRGOD-SQOUGZDYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | O[C@@H]1CO[C@@H](O)[C@H](F)[C@H]1O |
| SMILES | CACTVS | 3.370 | O[CH]1CO[CH](O)[CH](F)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1[C@H]([C@@H]([C@H]([C@@H](O1)O)F)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C1C(C(C(C(O1)O)F)O)O |
