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3-(4'-Methylthio)butylmalic acid

PropertiesImage
MNX_IDMNXM5505 Image of MNXM5505
referencechebi:80967
formulaC9H16O5S
global charge0
mol weight236.289
InChIKeyZIZLDVKLMYVMNX-UHFFFAOYSA-N
InChIInChI=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)
SMILESCSCCCCC(C(=O)O)C(O)C(=O)O
MNX internals
InChI (mnx)InChI=1/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)/t6?,7? Image of MNXM5505
SMILES (mnx)[CH3:1][S:15][CH2:5][CH2:3][CH2:2][CH2:4][CH:6]([CH:7]([C:9](=[O:13])[OH:14])[OH:10])[C:8](=[O:11])[OH:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:80967
chebi:80967
kegg.compound:C17219
keggC:C17219
ZIZLDVKLMYVMNX-UHFFFAOYSA-N 		3-(4'-Methylthio)butylmalic acid
3-(4'-Methylthio)butylmalate

seed.compound:cpd17409
seedM:cpd17409
ZIZLDVKLMYVMNX-UHFFFAOYSA-L 		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
hmdb:HMDB0304107
ZIZLDVKLMYVMNX-UHFFFAOYSA-L 		3-(4'-methylthio)butylmalate
2-Hydroxy-3-[4-(methylsulfanyl)butyl]butanedioic acid
2-Hydroxy-3-[4-(methylsulphanyl)butyl]butanedioate
2-Hydroxy-3-[4-(methylsulphanyl)butyl]butanedioic acid
2-hydroxy-3-[4-(methylsulfanyl)butyl]butanedioate
3-(4'-methylthio)Butylmalic acid

metacyc.compound:CPDQT-37
metacycM:CPDQT-37
ZIZLDVKLMYVMNX-UHFFFAOYSA-L 		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