(2Z)-2-(Ethylsulfanyl)-2-butenedioic acid (CHEBI:188833)

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CHEBI:188833 - (2Z)-2-(Ethylsulfanyl)-2-butenedioic acid

Default Structure

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ChEBI ID	CHEBI:188833
ChEBI Name	(2Z)-2-(Ethylsulfanyl)-2-butenedioic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C6H8O4S
Net Charge	0
Average Mass	176.193
Monoisotopic Mass	176.01433
SMILES	CCS/C(=C\C(=O)O)C(=O)O
InChI	InChI=1S/C6H8O4S/c1-2-11-4(6(9)10)3-5(7)8/h3H,2H2,1H3,(H,7,8)(H,9,10)/b4-3-
InChIKey	IKOFDMGPFDDETP-ARJAWSKDSA-N

Species of Metabolite	Component	Source	Comments
Phyllostachys violascens (ncbitaxon:1903417)	stem (BTO:0001300)	MetaboLights (MTBLS3970)	Strain: Phyllostachys violascens cv. Viridisulcata

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	(2Z)-2-(Ethylsulfanyl)-2-butenedioic acid (CHEBI:188833) is a dicarboxylic acid (CHEBI:35692)

IUPAC Name
(Z)-2-ethylsulanylbut-2-enedioic acid

Manual Xrefs	Databases
65326631	ChemSpider