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2-(4'-Methylthio)butylmalic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM5447

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₉H₁₆O₅S

charge

mass

236.07184

reference

InChIKey

MHYITDUVXNMMNZ-UHFFFAOYSA-N

InChI

InChI=1S/C9H16O5S/c1-15-5-3-2-4-9(14,8(12)13)6-7(10)11/h14H,2-6H2,1H3,(H,10,11)(H,12,13)

SMILES

CSCCCCC(O)(CC(=O)O)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:80966 chebi:80966 kegg.compound:C17218 keggC:C17218	2-(4'-Methylthio)butylmalic acid 2-(4'-Methylthio)butylmalate
seed.compound:cpd17408 seedM:cpd17408	2-(4'-Methylthio)butylmalate 2-(4'-Methylthio)butylmalic acid 2-(4'-methylthio)butylmalate 2-(4'-methylthio)butylmalic acid 2-[(4'-methylsulfanyl)butyl]malate 2-[(4'-methylthio)butyl]malate 2-[(4'-methylthio)butyl]malic acid
metacyc.compound:CPDQT-32 metacycM:CPDQT-32	2-[(4'-methylsulfanyl)butyl]malate 2-[(4'-methylthio)butyl]malate 2-[(4'-methylthio)butyl]malic acid
keggC:M_C17218 seedM:M_cpd17408	secondary/obsolete/fantasy identifier