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2-pyrone-6-carboxylate

PropertiesImage
MNX_IDMNXM164155 Image of MNXM164155
referencemetacycM:CPD-18742
formulaC6H3O4
global charge-1
mol weight139.086
InChIKeyAUZCNXBFVCKKHV-UHFFFAOYSA-M
InChIInChI=1S/C6H4O4/c7-5-3-1-2-4(10-5)6(8)9/h1-3H,(H,8,9)/p-1
SMILESO=C1C=CC=C(C(=O)[O-])O1
MNX internals
InChI (mnx)InChI=1/C6H4O4/c7-5-3-1-2-4(10-5)6(8)9/h1-3H,(H,8,9) Image of MNXM164155
SMILES (mnx)[CH:1]1=[CH:3][C:5](=[O:7])[O:10][C:4]([C:6]([OH:8])=[O:9])=[CH:2]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-18742
metacycM:CPD-18742
seed.compound:cpd34471
seedM:cpd34471
AUZCNXBFVCKKHV-UHFFFAOYSA-M
2-pyrone-6-carboxylate
2-pyrone-6-carboxylic acid

seedM:M_cpd34471
secondary/obsolete/fantasy identifier