Search MNXref
 Feedback

5-Carboxymethyl-2-hydroxymuconic semialdehyde

PropertiesImage
MNX_IDMNXM1364428 Image of MNXM1364428
referenceseedM:cpd02828
formulaC8H6O6
global charge-2
mol weight198.13
InChIKeyLDMRCLZHBLHHFW-UHFFFAOYSA-L
InChIInChI=1S/C8H8O6/c9-4-5(3-7(11)12)1-2-6(10)8(13)14/h1-2,4-5H,3H2,(H,11,12)(H,13,14)/p-2
SMILESO=CC(C=CC(=O)C(=O)[O-])CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C8H8O6/c9-4-5(3-7(11)12)1-2-6(10)8(13)14/h1-2,4-5H,3H2,(H,11,12)(H,13,14)/b2-1?/t5? Image of MNXM1364428
SMILES (mnx)[CH:1](=[CH:2][C:6]([C:8]([OH:13])=[O:14])=[O:10])[CH:5]([CH2:3][C:7](=[O:11])[OH:12])[CH:4]=[O:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd02828
seedM:cpd02828
LDMRCLZHBLHHFW-UHFFFAOYSA-L 		5-Carboxymethyl-2-hydroxymuconic semialdehyde
2-Hydroxy-5-carboxymethylmuconate semialdehyde
2-hydroxy-5-carboxymethyl-cis,cis-muconate 6-semialdehyde
2-hydroxy-5-carboxymethylmuconate 6-semialdehyde
2-hydroxy-5-carboxymethylmuconate semialdehyde
5-Carboxymethyl-2-hydroxymuconate semialdehyde
5-carboxymethyl-2-hydroxymuconate 6-semialdehyde
5-carboxymethyl-2-hydroxymuconate semialdehyde
5cm2hms

seedM:M_cpd02828 		secondary/obsolete/fantasy identifier