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2-Oxo-8-methylthiooctanoic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM3821

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	0

formula

C₉H₁₆O₃S

charge

mass

204.08202

reference

InChIKey

QDZNKMGEHAHOTA-UHFFFAOYSA-N

InChI

InChI=1S/C9H16O3S/c1-13-7-5-3-2-4-6-8(10)9(11)12/h2-7H2,1H3,(H,11,12)

SMILES

CSCCCCCCC(=O)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:80971 chebi:80971 kegg.compound:C17224 keggC:C17224	2-Oxo-8-methylthiooctanoic acid 8-Methylthio-2-octanoic acid
metacyc.compound:CPDQT-29 metacycM:CPDQT-29	8-(methylsulfanyl)-2-oxooctanoate 8-(methylthio)-2-oxooctanoate 8-(methylthio)-2-oxooctanoic acid
seed.compound:cpd17414 seedM:cpd17414	8-Methylthio-2-octanoic acid 2-Oxo-8-methylthiooctanoic acid 2-oxo-8-methylthiooctanoate 2-oxo-8-methylthiooctanoic acid 8-(methylsulfanyl)-2-oxooctanoate 8-(methylthio)-2-oxooctanoate 8-(methylthio)-2-oxooctanoic acid
keggC:M_C17224 seedM:M_cpd17414	secondary/obsolete/fantasy identifier