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3-(4'-Methylthio)butylmalic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM5505

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₉H₁₆O₅S

charge

mass

236.07184

reference

InChIKey

ZIZLDVKLMYVMNX-UHFFFAOYSA-N

InChI

InChI=1S/C9H16O5S/c1-15-5-3-2-4-6(8(11)12)7(10)9(13)14/h6-7,10H,2-5H2,1H3,(H,11,12)(H,13,14)

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:80967 chebi:80967 kegg.compound:C17219 keggC:C17219	3-(4'-Methylthio)butylmalic acid 3-(4'-Methylthio)butylmalate
seed.compound:cpd17409 seedM:cpd17409	3-(4'-Methylthio)butylmalate 3-(4'-Methylthio)butylmalic acid 3-(4'-methylthio)butylmalate 3-(4'-methylthio)butylmalic acid 3-[(4'-methylsulfanyl)butyl]malate 3-[(4'-methylthio)butyl]malate 3-[(4'-methylthio)butyl]malic acid
metacyc.compound:CPDQT-37 metacycM:CPDQT-37	3-[(4'-methylsulfanyl)butyl]malate 3-[(4'-methylthio)butyl]malate 3-[(4'-methylthio)butyl]malic acid
keggC:M_C17219 seedM:M_cpd17409	secondary/obsolete/fantasy identifier