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3-(6'-Methylthio)hexylmalic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM5507

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

formula

C₁₁H₂₀O₅S

charge

mass

264.10314

reference

InChIKey

LQQZHLHCFSCJCU-UHFFFAOYSA-N

InChI

InChI=1S/C11H20O5S/c1-17-7-5-3-2-4-6-8(10(13)14)9(12)11(15)16/h8-9,12H,2-7H2,1H3,(H,13,14)(H,15,16)

SMILES

CSCCCCCCC(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:80973 chebi:80973 kegg.compound:C17227 keggC:C17227	3-(6'-Methylthio)hexylmalic acid 3-(6'-Methylthio)hexylmalate
seed.compound:cpd17417 seedM:cpd17417	3-(6'-Methylthio)hexylmalate 3-(6'-Methylthio)hexylmalic acid 3-(6'-methylthio)hexylmalate 3-(6'-methylthio)hexylmalic acid 3-[(6'-methylsulfanyl)hexyl]malate 3-[(6'-methylthio)hexyl]malate 3-[(6'-methylthio)hexyl]malic acid
metacyc.compound:CPDQT-39 metacycM:CPDQT-39	3-[(6'-methylsulfanyl)hexyl]malate 3-[(6'-methylthio)hexyl]malate 3-[(6'-methylthio)hexyl]malic acid
keggC:M_C17227 seedM:M_cpd17417	secondary/obsolete/fantasy identifier