Terminology Service for NFDI4Health
4-[4-(3,5-dioxohexyl)phenylcarbamoyl]butyric acid
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http://purl.obolibrary.org/obo/CHEBI_63773
A carbamoyl derivative of butyric acid which includes a 1,3-diketone functionality.
Term info
Label
4-[4-(3,5-dioxohexyl)phenylcarbamoyl]butyric acid
Synonyms
- 5-{[4-(3,5-dioxohexyl)phenyl]amino}-5-oxopentanoic acid
Subsets
3_STAR
charge
0
formula
C17H21NO5
has obo namespace
chebi_ontology
id
CHEBI:63773
inchi
InChI=1S/C17H21NO5/c1-12(19)11-15(20)10-7-13-5-8-14(9-6-13)18-16(21)3-2-4-17(22)23/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,18,21)(H,22,23)
inchikey
KWUITAARNKUOMJ-UHFFFAOYSA-N
mass
319.35230
monoisotopicmass
319.14197
smiles
CC(=O)CC(=O)CCc1ccc(NC(=O)CCCC(O)=O)cc1