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2-Chloro-5-methyl-cis-dienelactone

PropertiesImage
MNX_IDMNXM6064 Image of MNXM6064
referencechebi:81655
formulaC7H5ClO4
global charge0
mol weight188.566
InChIKeyKPWMDCDICLSMLX-HWKANZROSA-N
InChIInChI=1S/C7H5ClO4/c1-3(6(9)10)5-2-4(8)7(11)12-5/h2H,1H3,(H,9,10)/b5-3+
SMILESC/C(C(=O)O)=C1/C=C(Cl)C(=O)O1
MNX internals
InChI (mnx)InChI=1/C7H5ClO4/c1-3(6(9)10)5-2-4(8)7(11)12-5/h2H,1H3,(H,9,10)/b5-3+ Image of MNXM6064
SMILES (mnx)[CH3:1]/[C:3](=[C:5]1/[CH:2]=[C:4]([Cl:8])[C:7](=[O:11])[O:12]1)[C:6](=[O:9])[OH:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...36f59424973f
envipathM:...36f59424973f
CHEBI:81655
chebi:81655
kegg.compound:C18304
keggC:C18304
KPWMDCDICLSMLX-HWKANZROSA-M
KPWMDCDICLSMLX-HWKANZROSA-N 		2-Chloro-5-methyl-cis-dienelactone
hmdb:HMDB0060345
KPWMDCDICLSMLX-HWKANZROSA-N 		2-Chloro-5-methyl-cis-dienelactone
2-[(2E)-4-chloro-5-oxo-2,5-dihydrofuran-2-ylidene]propanoic acid
2-[(2E)-4-chloro-5-oxofuran-2-ylidene]propanoic acid

seed.compound:cpd19570
seedM:cpd19570
KPWMDCDICLSMLX-HWKANZROSA-M 		2-Chloro-5-methyl-cis-dienelactone
2-chloro-5-methyl-dienelactone

metacyc.compound:CPD-10847
metacycM:CPD-10847
KPWMDCDICLSMLX-HWKANZROSA-M 		2-chloro-5-methyl-dienelactone

hmdb:HMDB60345
keggC:M_C18304
seedM:M_cpd19570 		secondary/obsolete/fantasy identifier