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3-(2-methylsulfanyl)ethylmalate

Properties

Image

Occurences in reactions

MNX_ID

MNXM5502

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

formula

C₇H₁₀O₅S

charge

-2

mass

206.02599

reference

InChIKey

UZRMQJKPFRLIDG-UHFFFAOYSA-L

InChI

InChI=1S/C7H12O5S/c1-13-3-2-4(6(9)10)5(8)7(11)12/h4-5,8H,2-3H2,1H3,(H,9,10)(H,11,12)/p-2

SMILES

CSCCC(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:133497 chebi:133497	3-(2-methylsulfanyl)ethylmalate 3-(2-methylthioethyl)malate(2-) 3-carboxylato-3,4-dideoxy-5-S-methyl-5-thiopentonate
seed.compound:cpd17402 seedM:cpd17402	3-(2'-Methylthio)ethylmalate 3-(2'-Methylthio)ethylmalic acid 3-(2'-methylthio)ethylmalic-acid 3-[(2'-methylsulfanyl)ethyl]malate 3-[(2'-methylsulfanyl)ethyl]malic acid
CHEBI:80963 chebi:80963 kegg.compound:C17212 keggC:C17212	3-(2'-Methylthio)ethylmalic acid 3-(2'-Methylthio)ethylmalate
CHEBI:134533 chebi:134533	3-(2-methylthioethyl)malic acid 3-carboxy-3,4-dideoxy-5-S-methyl-5-thiopentonic acid
metacyc.compound:3-2-METHYLTHIOETHYLMALIC-ACID metacycM:3-2-METHYLTHIOETHYLMALIC-ACID	3-[(2'-methylsulfanyl)ethyl]malate 3-[(2'-methylsulfanyl)ethyl]malic acid
keggC:M_C17212 seedM:M_cpd17402	secondary/obsolete/fantasy identifier