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CHEBI:134535 - 2-(2-methylthio)ethylmaleic acid

Default Structure
ChEBI IDCHEBI:134535
ChEBI Name2-(2-methylthio)ethylmaleic acid
Stars
DefinitionA 2-(ω-methylthio)alkylmaleic acid in which the 2-alkyl group is specified as 2-methylthioethyl.
Last Modified15 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC7H10O4S
Net Charge0
Average Mass190.220
Monoisotopic Mass190.02998
SMILESCSCC/C(=C/C(=O)O)C(=O)O
InChIInChI=1S/C7H10O4S/c1-12-3-2-5(7(10)11)4-6(8)9/h4H,2-3H2,1H3,(H,8,9)(H,10,11)/b5-4-
InChIKeyFCGNCJNTFRMBQY-PLNGDYQASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-(2-methylthio)ethylmaleic acid (CHEBI:134535) is a 2-(ω-methylthio)alkylmaleic acid (CHEBI:134534)
2-(2-methylthio)ethylmaleic acid (CHEBI:134535) is conjugate acid of 2-(2-methylthio)ethylmaleate(2−) (CHEBI:133499)
Incoming Relation(s)
2-(2-methylthio)ethylmaleate(2−) (CHEBI:133499) is conjugate base of 2-(2-methylthio)ethylmaleic acid (CHEBI:134535)
IUPAC Name 
(2Z)-2-[2-(methylsulfanyl)ethyl]but-2-enedioic acid
Manual XrefsDatabases
CPD-19476MetaCyc