CHEBI:86537 - 2,2-dimethylsuccinic acid

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ChEBI Name 2,2-dimethylsuccinic acid
ChEBI ID CHEBI:86537
Definition An α,ω-dicarboxylic acid that is succinic acid substituted by two methyl groups at positions 2 and 2 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H10O4
Net Charge 0
Average Mass 146.142
Monoisotopic Mass 146.05791
InChI InChI=1S/C6H10O4/c1-6(2,5(9)10)3-4(7)8/h3H2,1-2H3,(H,7,8)(H,9,10)
InChIKey GOHPTLYPQCTZSE-UHFFFAOYSA-N
SMILES CC(C)(CC(O)=O)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 2,2-dimethylsuccinic acid (CHEBI:86537) has functional parent succinic acid (CHEBI:15741)
2,2-dimethylsuccinic acid (CHEBI:86537) is a α,ω-dicarboxylic acid (CHEBI:28383)
2,2-dimethylsuccinic acid (CHEBI:86537) is conjugate acid of 2,2-dimethylsuccinate(2−) (CHEBI:191383)
Incoming 2,2-dimethylsuccinate(2−) (CHEBI:191383) is conjugate base of 2,2-dimethylsuccinic acid (CHEBI:86537)
IUPAC Name
2,2-dimethylbutanedioic acid
Synonyms Sources
α,α-dimethyl-succinic acid HMDB
α,α-dimethylsuccinic acid ChEBI
Manual Xrefs Databases
FDB022833 FooDB
HMDB0002074 HMDB
LMFA01170080 LIPID MAPS
WOC PDBeChem
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Registry Numbers Types Sources
1764476 Reaxys Registry Number Reaxys
597-43-3 CAS Registry Number NIST Chemistry WebBook
597-43-3 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12397032 PubMed citation Europe PMC
17164917 PubMed citation Europe PMC
24601008 PubMed citation Europe PMC
25111069 PubMed citation Europe PMC
26356151 PubMed citation Europe PMC
26856389 PubMed citation Europe PMC
Last Modified
09 May 2022