CHEBI:80642 - 2-Propyl-2,4-pentadienoic acid

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ChEBI Name 2-Propyl-2,4-pentadienoic acid
ChEBI ID CHEBI:80642
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C8H12O2
Net Charge 0
Average Mass 140.17970
Monoisotopic Mass 140.08373
InChI InChI=1S/C8H12O2/c1-3-5-7(6-4-2)8(9)10/h3,5H,1,4,6H2,2H3,(H,9,10)/b7-5+
InChIKey UUILWXIBBZVJDU-FNORWQNLSA-N
SMILES CCC\C(=C/C=C)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-Propyl-2,4-pentadienoic acid (CHEBI:80642) is a methyl-branched fatty acid (CHEBI:62499)
Synonym Source
2,4-Diene-VPA KEGG COMPOUND
Manual Xrefs Databases
C16656 KEGG COMPOUND
HMDB0060682 HMDB
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Registry Number Type Source
72010-18-5 CAS Registry Number KEGG COMPOUND