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4-carboxy-2-hydroxymuconate semialdehyde hemiacetal

PropertiesImage
MNX_IDMNXM2943 Image of MNXM2943
referencechebi:61985
formulaC7H4O6
global charge-2
mol weight184.103
InChIKeyMLOJGZHQNWCBAC-UHFFFAOYSA-L
InChIInChI=1S/C7H6O6/c8-5-2-3(6(9)10)1-4(13-5)7(11)12/h1-2,5,8H,(H,9,10)(H,11,12)/p-2
SMILESO=C([O-])C1=CC(O)OC(C(=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C7H6O6/c8-5-2-3(6(9)10)1-4(13-5)7(11)12/h1-2,5,8H,(H,9,10)(H,11,12)/t5? Image of MNXM2943
SMILES (mnx)[CH:1]1=[C:4]([C:7]([OH:11])=[O:12])[O:13][CH:5]([OH:8])[CH:2]=[C:3]1[C:6](=[O:9])[OH:10]
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

CHEBI:61985
chebi:61985
MLOJGZHQNWCBAC-UHFFFAOYSA-L 		4-carboxy-2-hydroxymuconate semialdehyde hemiacetal
2-hydroxy-2H-pyran-4,6-dicarboxylate
4-carboxy-2-hydroxymuconate semialdehyde hemiacetal(2-)

kegg.compound:C05375
keggC:C05375
vmhM:3h2hp46dc
vmhmetabolite:3h2hp46dc
MLOJGZHQNWCBAC-UHFFFAOYSA-N 		2-Hydroxy-2-hydropyrone-4,6-dicarboxylate

seed.compound:cpd03183
seedM:cpd03183
MLOJGZHQNWCBAC-UHFFFAOYSA-L 		2-Hydroxy-2-hydropyrone-4,6-dicarboxylate
2-hydroxy-4-carboxymuconate semialdehyde hemiacetal
6-hydroxy-6H-pyran-2,4-dicarboxylate

metacyc.compound:CPD-2542
metacycM:CPD-2542
MLOJGZHQNWCBAC-UHFFFAOYSA-L 		2-hydroxy-4-carboxymuconate semialdehyde hemiacetal
6-hydroxy-6H-pyran-2,4-dicarboxylate

CHEBI:62011
chebi:62011
MLOJGZHQNWCBAC-UHFFFAOYSA-N 		4-carboxy-2-hydroxymuconate semialdehyde hemiacetal
2-hydroxy-2-hydropyrone-4,6-dicarboxylic acid
2-hydroxy-2H-pyran-4,6-dicarboxylic acid

keggC:M_C05375
seedM:M_cpd03183
vmhM:M_3h2hp46dc 		secondary/obsolete/fantasy identifier