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2-(2-methylsulfanyl)ethylmaleate

PropertiesImage
MNX_IDMNXM164095 Image of MNXM164095
referencechebi:133499
formulaC7H8O4S
global charge-2
mol weight188.204
InChIKeyFCGNCJNTFRMBQY-PLNGDYQASA-L
InChIInChI=1S/C7H10O4S/c1-12-3-2-5(7(10)11)4-6(8)9/h4H,2-3H2,1H3,(H,8,9)(H,10,11)/p-2/b5-4-
SMILESCSCC/C(=C/C(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C7H10O4S/c1-12-3-2-5(7(10)11)4-6(8)9/h4H,2-3H2,1H3,(H,8,9)(H,10,11)/b5-4- Image of MNXM164095
SMILES (mnx)[CH3:1][S:12][CH2:3][CH2:2]/[C:5](=[CH:4]/[C:6](=[O:8])[OH:9])[C:7](=[O:10])[OH:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:133499
chebi:133499
FCGNCJNTFRMBQY-PLNGDYQASA-L 		2-(2-methylsulfanyl)ethylmaleate
(2Z)-2-[2-(methylsulfanyl)ethyl]but-2-enedioate
2-(2-methylthio)ethylmaleate(2-)

CHEBI:134535
chebi:134535
FCGNCJNTFRMBQY-PLNGDYQASA-N 		2-(2-methylthio)ethylmaleic acid
(2Z)-2-[2-(methylsulfanyl)ethyl]but-2-enedioic acid

metacyc.compound:CPD-19476
metacycM:CPD-19476
seed.compound:cpd33422
seedM:cpd33422
FCGNCJNTFRMBQY-PLNGDYQASA-L 		2-[(2'-methylsulfanyl)ethyl]maleate
2-[(2'-methylthio)ethyl]maleate

seedM:M_cpd33422 		secondary/obsolete/fantasy identifier