CHEBI:17275 - 2-isopropylmaleic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-isopropylmaleic acid
ChEBI ID CHEBI:17275
Definition The 2-isopropyl derivative of maleic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11604, CHEBI:1179, CHEBI:19668
Supplier Information
Save molfile Download Molfile
Formula C7H10O4
Net Charge 0
Average Mass 158.15190
Monoisotopic Mass 158.058
InChI InChI=1S/C7H10O4/c1-4(2)5(7(10)11)3-6(8)9/h3-4H,1-2H3,(H,8,9)(H,10,11)/b5-3-
InChIKey NJMGRJLQRLFQQX-HYXAFXHYSA-N
SMILES CC(C)C(\C(O)=O)=C\C(O)=O
Metabolite of Species Details
Escherichia coli (NCBI:562) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-isopropylmaleic acid (CHEBI:17275) has functional parent maleic acid (CHEBI:18300)
2-isopropylmaleic acid (CHEBI:17275) has role Escherichia coli metabolite (CHEBI:76971)
2-isopropylmaleic acid (CHEBI:17275) is a dicarboxylic acid (CHEBI:35692)
2-isopropylmaleic acid (CHEBI:17275) is conjugate acid of 2-isopropylmaleate(2−) (CHEBI:58085)
Incoming 2-isopropylmaleate(2−) (CHEBI:58085) is conjugate base of 2-isopropylmaleic acid (CHEBI:17275)
IUPAC Name
(2Z)-2-(propan-2-yl)but-2-enedioic acid
Synonyms Sources
2-Isopropylmaleate KEGG COMPOUND
2-isopropylmaleic acid UniProt
beta-Isopropylmaleate KEGG COMPOUND
Database Link Database
C02631 KEGG COMPOUND
View more database links
Last Modified
25 January 2016