CHEBI:166925 - Allylmalonic acid

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ChEBI Name Allylmalonic acid
ChEBI ID CHEBI:166925
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C6H8O4
Net Charge 0
Average Mass 144.126
Monoisotopic Mass 144.04226
InChI InChI=1S/C6H8O4/c1-2-3-4(5(7)8)6(9)10/h2,4H,1,3H2,(H,7,8)(H,9,10)
InChIKey ZDZVKPXKLLLOOA-UHFFFAOYSA-N
SMILES OC(=O)C(CC=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 Allylmalonic acid (CHEBI:166925) is a branched-chain fatty acid (CHEBI:35819)
IUPAC Name
2-prop-2-enylpropanedioic acid
Manual Xref Database
68265 ChemSpider
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Registry Number Type Source
2583-25-7 CAS Registry Number ChemIDplus