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CHEBI:200136 - (+/-)-ethylitaconic acid

ChEBI IDCHEBI:200136
ChEBI Name(+/-)-ethylitaconic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H10O4
Net Charge0
Average Mass158.153
Monoisotopic Mass158.05791
SMILESC=C(C(=O)O)[C@H](CC)C(=O)O
InChIInChI=1S/C7H10O4/c1-3-5(7(10)11)4(2)6(8)9/h5H,2-3H2,1H3,(H,8,9)(H,10,11)/t5-/m0/s1
InChIKeyJYLVYKQVUQBCBP-YFKPBYRVSA-N
Species of MetaboliteComponentSourceComments
Graphis scripta (ncbitaxon:71600) - DOI (10.3987/com-14-13107)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(+/-)-ethylitaconic acid (CHEBI:200136) is a methyl-branched fatty acid (CHEBI:62499)
IUPAC Name 
2-ethyl-3-methylidenebutanedioic acid
Manual XrefsDatabases
11325997ChemSpider