3-(3'-Methylthio)propylmalic acid (CHEBI:80964)

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CHEBI:80964 - 3-(3'-Methylthio)propylmalic acid

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ChEBI ID	CHEBI:80964
ChEBI Name	3-(3'-Methylthio)propylmalic acid
Stars
Downloads	Molfile

Formula	C8H14O5S
Net Charge	0
Average Mass	222.262
Monoisotopic Mass	222.05619
SMILES	CSCCCC(C(=O)O)C(O)C(=O)O
InChI	InChI=1S/C8H14O5S/c1-14-4-2-3-5(7(10)11)6(9)8(12)13/h5-6,9H,2-4H2,1H3,(H,10,11)(H,12,13)
InChIKey	SQXVIIOPMYSNCP-UHFFFAOYSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	3-(3'-Methylthio)propylmalic acid (CHEBI:80964) is a dicarboxylic acid (CHEBI:35692)

Synonym	Source
3-(3'-Methylthio)propylmalate	KEGG COMPOUND

Manual Xrefs	Databases
C17215	KEGG COMPOUND