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2-(5'-Methylthio)pentylmalic acid

PropertiesImage
MNX_IDMNXM5448 Image of MNXM5448
referencechebi:80969
formulaC10H18O5S
global charge0
mol weight250.316
InChIKeyOKIIWFXZWJTTLY-UHFFFAOYSA-N
InChIInChI=1S/C10H18O5S/c1-16-6-4-2-3-5-10(15,9(13)14)7-8(11)12/h15H,2-7H2,1H3,(H,11,12)(H,13,14)
SMILESCSCCCCCC(O)(CC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C10H18O5S/c1-16-6-4-2-3-5-10(15,9(13)14)7-8(11)12/h15H,2-7H2,1H3,(H,11,12)(H,13,14)/t10? Image of MNXM5448
SMILES (mnx)[CH3:1][S:16][CH2:6][CH2:4][CH2:2][CH2:3][CH2:5][C:10]([CH2:7][C:8](=[O:11])[OH:12])([C:9](=[O:13])[OH:14])[OH:15]
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:80969
chebi:80969
kegg.compound:C17222
keggC:C17222
OKIIWFXZWJTTLY-UHFFFAOYSA-N 		2-(5'-Methylthio)pentylmalic acid
2-(5'-Methylthio)pentylmalate

seed.compound:cpd17412
seedM:cpd17412
OKIIWFXZWJTTLY-UHFFFAOYSA-L 		2-(5'-Methylthio)pentylmalate
2-(5'-Methylthio)pentylmalic acid
2-(5'-methylthio)pentylmalate
2-(5'-methylthio)pentylmalic acid
2-[(5'-methylsulfanyl)pentyl]malate
2-[(5'-methylthio)pentyl]malate
2-[(5'-methylthio)pentyl]malic acid
hmdb:HMDB0304052
OKIIWFXZWJTTLY-UHFFFAOYSA-L 		2-(5'-methylthio)pentylmalate
2-(5'-methylthio)Pentylmalic acid
2-[(5'-Methylthio)pentyl]malic acid
2-hydroxy-2-[5-(methylsulfanyl)pentyl]butanedioate

metacyc.compound:CPDQT-33
metacycM:CPDQT-33
OKIIWFXZWJTTLY-UHFFFAOYSA-L 		2-[(5'-methylsulfanyl)pentyl]malate
2-[(5'-methylthio)pentyl]malate
2-[(5'-methylthio)pentyl]malic acid

keggC:M_C17222
seedM:M_cpd17412 		secondary/obsolete/fantasy identifier