EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:118768 - N-[2-[(2S,5S,6R)-5-[[(2,5-difluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide

ChEBI IDCHEBI:118768
ChEBI NameN-[2-[(2S,5S,6R)-5-[[(2,5-difluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
Stars
DownloadsMolfile
FormulaC20H23F2N5O4
Net Charge0
Average Mass435.431
Monoisotopic Mass435.17181
SMILESO=C(Nc1cc(F)ccc1F)N[C@H]1CC[C@@H](CCNC(=O)c2cnccn2)O[C@H]1CO
InChIInChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18-/m0/s1
InChIKeyAWOFXEOJWLHGJO-YEWWUXTCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-[(2S,5S,6R)-5-[[(2,5-difluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide (CHEBI:118768) is a C-glycosyl compound (CHEBI:20857)
Manual XrefsDatabases
LSM-30217LINCS