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CHEBI:207070 - (2R)-N-[(2S)-7-[(1-acetylcyclopropyl)amino]-5,7-dioxoheptan-2-yl]-2-(tetradecanoylamino)butanediamide

ChEBI IDCHEBI:207070
ChEBI Name(2R)-N-[(2S)-7-[(1-acetylcyclopropyl)amino]-5,7-dioxoheptan-2-yl]-2-(tetradecanoylamino)butanediamide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H52N4O6
Net Charge0
Average Mass564.768
Monoisotopic Mass564.38869
SMILESCCCCCCCCCCCCCC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](C)CCC(=O)CC(=O)NC1(C(C)=O)CC1
InChIInChI=1S/C30H52N4O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-27(38)33-25(21-26(31)37)29(40)32-22(2)16-17-24(36)20-28(39)34-30(18-19-30)23(3)35/h22,25H,4-21H2,1-3H3,(H2,31,37)(H,32,40)(H,33,38)(H,34,39)/t22-,25+/m0/s1
InChIKeyQMWRTLNJIANVKP-WIOPSUGQSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (26052818)
ChEBI Ontology
Outgoing Relation(s)
(2R)-N-[(2S)-7-[(1-acetylcyclopropyl)amino]-5,7-dioxoheptan-2-yl]-2-(tetradecanoylamino)butanediamide (CHEBI:207070) is a β-hydroxy ketone (CHEBI:55380)
IUPAC Name 
(2R)-N-[(2S)-7-[(1-acetylcyclopropyl)amino]-5,7-dioxoheptan-2-yl]-2-(tetradecanoylamino)butanediamide
Manual XrefsDatabases
78441272ChemSpider