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CHEBI:98972 - 1-[(2R,3R,6R)-6-[2-(4-cyclopropyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-(2,5-difluorophenyl)urea

ChEBI IDCHEBI:98972
ChEBI Name1-[(2R,3R,6R)-6-[2-(4-cyclopropyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-(2,5-difluorophenyl)urea
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DownloadsMolfile
FormulaC20H25F2N5O3
Net Charge0
Average Mass421.448
Monoisotopic Mass421.19255
SMILESO=C(Nc1cc(F)ccc1F)N[C@@H]1CC[C@H](CCn2cc(C3CC3)nn2)O[C@H]1CO
InChIInChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19+/m1/s1
InChIKeyHBSXUOUHADHDTK-OGWOLHLISA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2R,3R,6R)-6-[2-(4-cyclopropyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-(2,5-difluorophenyl)urea (CHEBI:98972) is a C-glycosyl compound (CHEBI:20857)
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