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CHEBI:181309 - (3E,5E)-2-(4-Methoxy-4-oxobutyl)nona-3,5-dienoic acid

ChEBI IDCHEBI:181309
ChEBI Name(3E,5E)-2-(4-Methoxy-4-oxobutyl)nona-3,5-dienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22O4
Net Charge0
Average Mass254.326
Monoisotopic Mass254.15181
SMILESCCC/C=C/C=C/C(CCCC(=O)OC)C(=O)O
InChIInChI=1S/C14H22O4/c1-3-4-5-6-7-9-12(14(16)17)10-8-11-13(15)18-2/h5-7,9,12H,3-4,8,10-11H2,1-2H3,(H,16,17)/b6-5+,9-7+
InChIKeyQPFWOYDHBWPHSS-SBIWHPGTSA-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)
(3E,5E)-2-(4-Methoxy-4-oxobutyl)nona-3,5-dienoic acid (CHEBI:181309) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
(3E,5E)-2-(4-methoxy-4-oxobutyl)nona-3,5-dienoic acid
Manual XrefsDatabases
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