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CHEBI:182225 - 5-Amino-3-[(2E)-2-(3,5-dimethyl-2-oxocyclohexylidene)ethyl]-5-oxopentanoic acid

ChEBI IDCHEBI:182225
ChEBI Name5-Amino-3-[(2E)-2-(3,5-dimethyl-2-oxocyclohexylidene)ethyl]-5-oxopentanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H23NO4
Net Charge0
Average Mass281.352
Monoisotopic Mass281.16271
SMILESCC1C/C(=C\CC(CC(N)=O)CC(=O)O)C(=O)C(C)C1
InChIInChI=1S/C15H23NO4/c1-9-5-10(2)15(20)12(6-9)4-3-11(7-13(16)17)8-14(18)19/h4,9-11H,3,5-8H2,1-2H3,(H2,16,17)(H,18,19)/b12-4+
InChIKeyVUHCEJPYCQSKEW-UUILKARUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-Amino-3-[(2E)-2-(3,5-dimethyl-2-oxocyclohexylidene)ethyl]-5-oxopentanoic acid (CHEBI:182225) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
5-amino-3-[(2E)-2-(3,5-dimethyl-2-oxocyclohexylidene)ethyl]-5-oxopentanoic acid
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