Search MNXref
 Feedback

2-(3-methylsulfanyl)propylmalate

PropertiesImage
MNX_IDMNXM3443 Image of MNXM3443
referencechebi:58817
formulaC8H12O5S
global charge-2
mol weight220.246
InChIKeyWLOKFRZXOVZGIN-UHFFFAOYSA-L
InChIInChI=1S/C8H14O5S/c1-14-4-2-3-8(13,7(11)12)5-6(9)10/h13H,2-5H2,1H3,(H,9,10)(H,11,12)/p-2
SMILESCSCCCC(O)(CC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C8H14O5S/c1-14-4-2-3-8(13,7(11)12)5-6(9)10/h13H,2-5H2,1H3,(H,9,10)(H,11,12)/t8? Image of MNXM3443
SMILES (mnx)[CH3:1][S:14][CH2:4][CH2:2][CH2:3][C:8]([CH2:5][C:6](=[O:9])[OH:10])([C:7](=[O:11])[OH:12])[OH:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58817
chebi:58817
WLOKFRZXOVZGIN-UHFFFAOYSA-L 		2-(3-methylsulfanyl)propylmalate
2-(3-methylthiopropyl)malate(2-)
2-hydroxy-2-[3-(methylsulfanyl)propyl]butanedioate
2-hydroxy-2-[3-(methylsulfanyl)propyl]succinate

seed.compound:cpd17404
seedM:cpd17404
WLOKFRZXOVZGIN-UHFFFAOYSA-L 		2-(3'-Methylthio)propylmalate
2-(3'-Methylthio)propylmalic acid
2-(3'-methylthio)propylmalate
2-(3'-methylthio)propylmalic acid
2-[(3'-methylsulfanyl)propyl]malate
2-[(3'-methylthio)propyl]malate
2-[(3'-methylthio)propyl]malic acid

kegg.compound:C17214
keggC:C17214
WLOKFRZXOVZGIN-UHFFFAOYSA-N 		2-(3'-Methylthio)propylmalic acid
2-(3'-Methylthio)propylmalate
hmdb:HMDB0304050
WLOKFRZXOVZGIN-UHFFFAOYSA-L 		2-(3'-methylthio)propylmalate
2-(3'-Methylthio)propylmalic acid
2-(3-Methylsulfanyl)propylmalate
2-(3-Methylsulfanyl)propylmalic acid
2-(3-Methylsulphanyl)propylmalate
2-(3-Methylsulphanyl)propylmalic acid
2-(3-Methylthiopropyl)malic acid(2-)
2-(3-methylthiopropyl)malate
2-Hydroxy-2-[3-(methylsulfanyl)propyl]succinate
2-Hydroxy-2-[3-(methylsulfanyl)propyl]succinic acid
2-Hydroxy-2-[3-(methylsulphanyl)propyl]succinate
2-Hydroxy-2-[3-(methylsulphanyl)propyl]succinic acid
2-hydroxy-2-[3-(methylsulfanyl)propyl]butanedioate

CHEBI:50262
chebi:50262
WLOKFRZXOVZGIN-UHFFFAOYSA-N 		2-(3-methylthiopropyl)malic acid
2-(3'-Methylthio)propylmalate
2-hydroxy-2-[3-(methylsulfanyl)propyl]butanedioic acid
MTPM

metacyc.compound:CPDQT-31
metacycM:CPDQT-31
WLOKFRZXOVZGIN-UHFFFAOYSA-L 		2-[(3'-methylsulfanyl)propyl]malate
2-[(3'-methylthio)propyl]malate
2-[(3'-methylthio)propyl]malic acid

keggC:M_C17214
seedM:M_cpd17404 		secondary/obsolete/fantasy identifier