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CHEBI:120094 - 2-fluoro-N-[2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(3-methylphenyl)sulfonylamino]-2-oxanyl]ethyl]benzenesulfonamide

ChEBI IDCHEBI:120094
ChEBI Name2-fluoro-N-[2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(3-methylphenyl)sulfonylamino]-2-oxanyl]ethyl]benzenesulfonamide
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FormulaC21H27FN2O6S2
Net Charge0
Average Mass486.587
Monoisotopic Mass486.12946
SMILESCc1cccc(S(=O)(=O)N[C@@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3F)O[C@@H]2CO)c1
InChIInChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20+/m0/s1
InChIKeyJUMQDWHPHZAWJD-PWIZWCRZSA-N
ChEBI Ontology
Outgoing Relation(s)
2-fluoro-N-[2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(3-methylphenyl)sulfonylamino]-2-oxanyl]ethyl]benzenesulfonamide (CHEBI:120094) is a C-glycosyl compound (CHEBI:20857)
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