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4-Methyl-3-oxoadipate-enol-lactone

PropertiesImage
MNX_IDMNXM6896 Image of MNXM6896
referencechebi:81662
formulaC7H8O4
global charge0
mol weight156.137
InChIKeyDAJDHKXIQYXYPH-UHFFFAOYSA-N
InChIInChI=1S/C7H8O4/c1-4-2-7(10)11-5(4)3-6(8)9/h2-3H2,1H3,(H,8,9)
SMILESCC1=C(CC(=O)O)OC(=O)C1
MNX internals
InChI (mnx)InChI=1/C7H8O4/c1-4-2-7(10)11-5(4)3-6(8)9/h2-3H2,1H3,(H,8,9) Image of MNXM6896
SMILES (mnx)[CH3:1][C:4]1=[C:5]([CH2:3][C:6](=[O:8])[OH:9])[O:11][C:7](=[O:10])[CH2:2]1
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

envipath:...40d71181e993
envipathM:...40d71181e993
CHEBI:81662
chebi:81662
kegg.compound:C18311
keggC:C18311
DAJDHKXIQYXYPH-UHFFFAOYSA-M
DAJDHKXIQYXYPH-UHFFFAOYSA-N
4-Methyl-3-oxoadipate-enol-lactone

seed.compound:cpd19577
seedM:cpd19577
DAJDHKXIQYXYPH-UHFFFAOYSA-M
4-Methyl-3-oxoadipate-enol-lactone
4-methyl-3-oxoadipate-enol-lactone

metacyc.compound:CPD-10825
metacycM:CPD-10825
DAJDHKXIQYXYPH-UHFFFAOYSA-M
4-methyl-3-oxoadipate-enol-lactone

keggC:M_C18311
seedM:M_cpd19577
secondary/obsolete/fantasy identifier