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2-(4'-Methylthio)butylmalic acid

PropertiesImage
MNX_IDMNXM5447 Image of MNXM5447
referencechebi:80966
formulaC9H16O5S
global charge0
mol weight236.289
InChIKeyMHYITDUVXNMMNZ-UHFFFAOYSA-N
InChIInChI=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)
SMILESCSCCCCC(O)(CC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/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)/t9? Image of MNXM5447
SMILES (mnx)[CH3:1][S:15][CH2:5][CH2:3][CH2:2][CH2:4][C:9]([CH2:6][C:7](=[O:10])[OH:11])([C:8](=[O:12])[OH:13])[OH:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:80966
chebi:80966
kegg.compound:C17218
keggC:C17218
MHYITDUVXNMMNZ-UHFFFAOYSA-N 		2-(4'-Methylthio)butylmalic acid
2-(4'-Methylthio)butylmalate

seed.compound:cpd17408
seedM:cpd17408
MHYITDUVXNMMNZ-UHFFFAOYSA-L 		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
hmdb:HMDB0304051
MHYITDUVXNMMNZ-UHFFFAOYSA-L 		2-(4'-methylthio)butylmalate
2-(4'-methylthio)Butylmalic acid
2-Hydroxy-2-[4-(methylsulfanyl)butyl]butanedioic acid
2-Hydroxy-2-[4-(methylsulphanyl)butyl]butanedioate
2-Hydroxy-2-[4-(methylsulphanyl)butyl]butanedioic acid
2-hydroxy-2-[4-(methylsulfanyl)butyl]butanedioate

metacyc.compound:CPDQT-32
metacycM:CPDQT-32
MHYITDUVXNMMNZ-UHFFFAOYSA-L 		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