4-Carboxymethyl-2,4-dimethylbut-2-en-1,4 (CHEBI:200032)

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CHEBI:200032 - 4-Carboxymethyl-2,4-dimethylbut-2-en-1,4

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ChEBI ID	CHEBI:200032
ChEBI Name	4-Carboxymethyl-2,4-dimethylbut-2-en-1,4
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C8H10O4
Net Charge	0
Average Mass	170.164
Monoisotopic Mass	170.05791
SMILES	CC1=C[C@](C)(CC(=O)O)OC1=O
InChI	InChI=1S/C8H10O4/c1-5-3-8(2,4-6(9)10)12-7(5)11/h3H,4H2,1-2H3,(H,9,10)/t8-/m1/s1
InChIKey	CUYYJUFSLQRLEZ-MRVPVSSYSA-N

Species of Metabolite	Component	Source	Comments
Rhodococcus rhodochrous (ncbitaxon:1829)	-	DOI (10.1016/0378-1097(94)00181-2)

ChEBI Ontology

Outgoing Relation(s)
	4-Carboxymethyl-2,4-dimethylbut-2-en-1,4 (CHEBI:200032) is a butenolide (CHEBI:50523)

IUPAC Name
2-(2,4-dimethyl-5-oxouran-2-yl)acetic acid

Manual Xrefs	Databases
67024490	ChemSpider