CHEBI:123137 - N-[2-[(2R,5S,6R)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]cyclohexanecarboxamide

ChEBI IDCHEBI:123137
ChEBI NameN-[2-[(2R,5S,6R)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]cyclohexanecarboxamide
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FormulaC22H32FN3O4
Net Charge0
Average Mass421.513
Monoisotopic Mass421.23768
SMILESO=C(Nc1ccccc1F)N[C@H]1CC[C@H](CCNC(=O)C2CCCCC2)O[C@H]1CO
InChIInChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m1/s1
InChIKeyABKGFAHRWOKBSI-UXPWSPDFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-[(2R,5S,6R)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]cyclohexanecarboxamide (CHEBI:123137) is a C-glycosyl compound (CHEBI:20857)
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