FMF
Summary
Name: | 2-deoxy-2-fluoro-beta-D-mannopyranosyl fluoride |
Synonyms: | 2-DEOXY-2-FLUOROHEXOPYRANOSYL FLUORIDE 2-DEOXY-2-FLUORO-ALPHA-D-MANNOSYL FLUORIDE; 2-deoxy-2-fluoro-beta-D-mannosyl fluoride; 2-deoxy-2-fluoro-D-mannosyl fluoride; 2-deoxy-2-fluoro-mannosyl fluoride |
Formula: | C6 H10 F2 O4 |
Formal charge: | 0 |
Formula weight: | 184.138 Da |
Component type: | D-saccharide |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-deoxy-2-fluoro-beta-D-mannopyranosyl fluoride |
OpenEye OEToolkits | 1.5.0 | (2R,3S,4S,5S,6S)-5,6-difluoro-2-(hydroxymethyl)oxane-3,4-diol |
PDB-CARE | 1.0 | b-D-Manp1fluoro2fluoro |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | FC1C(O)C(O)C(OC1F)CO |
SMILES_CANONICAL | CACTVS | 3.341 | OC[C@H]1O[C@@H](F)[C@@H](F)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.341 | OC[CH]1O[CH](F)[CH](F)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)F)F)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(C(O1)F)F)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C6H10F2O4/c7-3-5(11)4(10)2(1-9)12-6(3)8/h2-6,9-11H,1H2/t2-,3+,4-,5-,6?/m1/s1 |
InChIKey | InChI | 1.03 | YZRDPODBASCWCK-CBPJZXOFSA-N |