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3-oxalomalate

PropertiesImage
MNX_IDMNXM3850 Image of MNXM3850
referencechebi:15593
formulaC6H3O8
global charge-3
mol weight203.082
InChIKeyYILAUJBAPQXZGM-UHFFFAOYSA-K
InChIInChI=1S/C6H6O8/c7-2(5(11)12)1(4(9)10)3(8)6(13)14/h1-2,7H,(H,9,10)(H,11,12)(H,13,14)/p-3
SMILESO=C([O-])C(=O)C(C(=O)[O-])C(O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C6H6O8/c7-2(5(11)12)1(4(9)10)3(8)6(13)14/h1-2,7H,(H,9,10)(H,11,12)(H,13,14)/t1?,2? Image of MNXM3850
SMILES (mnx)[CH:1]([CH:2]([C:5](=[O:11])[OH:12])[OH:7])([C:3]([C:6]([OH:13])=[O:14])=[O:8])[C:4](=[O:9])[OH:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:15593
chebi:15593
YILAUJBAPQXZGM-UHFFFAOYSA-K
3-oxalomalate
1-hydroxy-3-oxopropane-1,2,3-tricarboxylate
3-oxalomalate(3-)

vmhM:3omal
vmhmetabolite:3omal
YILAUJBAPQXZGM-UHFFFAOYSA-K
3-Oxalomalate

kegg.compound:C01990
keggC:C01990
YILAUJBAPQXZGM-UHFFFAOYSA-N
3-Oxalomalate
3-Oxalomalic acid

seed.compound:cpd01363
seedM:cpd01363
YILAUJBAPQXZGM-UHFFFAOYSA-K
3-Oxalomalate
3-Oxalomalic acid
3-oxalomalate
3-oxalomalic acid
oxalomalate
oxalomalic acid
hmdb:HMDB0245962
YILAUJBAPQXZGM-UHFFFAOYSA-N
3-Oxalomalic acid
1-Hydroxy-3-oxo-1,2,3-propanetricarboxylate
1-Hydroxy-3-oxo-1,2,3-propanetricarboxylic acid
1-hydroxy-3-oxopropane-1,2,3-tricarboxylic acid
3-Oxalomalate
Oxalomalate
Oxalomalic acid
oxalomalic acid

metacyc.compound:CPD-628
metacycM:CPD-628
YILAUJBAPQXZGM-UHFFFAOYSA-K
3-oxalomalate
3-oxalomalic acid
oxalomalate
oxalomalic acid

CHEBI:30926
chebi:30926
YILAUJBAPQXZGM-UHFFFAOYSA-N
3-oxalomalic acid
1-hydroxy-3-oxo-1,2,3-propanetricarboxylic acid
1-hydroxy-3-oxopropane-1,2,3-tricarboxylic acid
3-Oxalomalic acid

chebi:11865
chebi:1618
chebi:20146
chebi:20147
keggC:M_C01990
seedM:M_cpd01363
vmhM:M_3omal
secondary/obsolete/fantasy identifier