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2-[(2'-methylsulfanyl)hexyl]maleate

PropertiesImage
MNX_IDMNXM164092 Image of MNXM164092
referencemetacycM:CPD-19480
formulaC11H16O4S
global charge-2
mol weight244.312
InChIKeyBDWTWLBLUBGINP-HJWRWDBZSA-L
InChIInChI=1S/C11H18O4S/c1-16-7-5-3-2-4-6-9(11(14)15)8-10(12)13/h8H,2-7H2,1H3,(H,12,13)(H,14,15)/p-2/b9-8-
SMILESCSCCCCCC/C(=C/C(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C11H18O4S/c1-16-7-5-3-2-4-6-9(11(14)15)8-10(12)13/h8H,2-7H2,1H3,(H,12,13)(H,14,15)/b9-8- Image of MNXM164092
SMILES (mnx)[CH3:1][S:16][CH2:7][CH2:5][CH2:3][CH2:2][CH2:4][CH2:6]/[C:9](=[CH:8]/[C:10](=[O:12])[OH:13])[C:11](=[O:14])[OH:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-19480
metacycM:CPD-19480
seed.compound:cpd32696
seedM:cpd32696
BDWTWLBLUBGINP-HJWRWDBZSA-L
2-[(2'-methylsulfanyl)hexyl]maleate
2-[(2'-methylthio)hexyl]maleate

seedM:M_cpd32696
secondary/obsolete/fantasy identifier