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CHEBI:198816 - (Z)-2-hexylpent-2-enedioic acid

ChEBI IDCHEBI:198816
ChEBI Name(Z)-2-hexylpent-2-enedioic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18O4
Net Charge0
Average Mass214.261
Monoisotopic Mass214.12051
SMILESCCCCCC/C(=C/CC(=O)O)C(=O)O
InChIInChI=1S/C11H18O4/c1-2-3-4-5-6-9(11(14)15)7-8-10(12)13/h7H,2-6,8H2,1H3,(H,12,13)(H,14,15)/b9-7-
InChIKeyWXOGMCJBJKIXPV-CLFYSBASSA-N
Species of MetaboliteComponentSourceComments
Gongronella butleri (ncbitaxon:101105) - DOI (10.1016/j.phytol.2014.09.001)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(Z)-2-hexylpent-2-enedioic acid (CHEBI:198816) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
(Z)-2-hexylpent-2-enedioic acid
Manual XrefsDatabases
78435838ChemSpider