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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:80642 - 2-Propyl-2,4-pentadienoic acid
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ChEBI Ontology
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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.
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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 (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
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
View more database links
Registry Number
Type
Source
72010-18-5
CAS Registry Number
KEGG COMPOUND