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(2S)-2-hydroxy-4-oxobutane-1,2,4-tricarboxylate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1522

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₇H₅O₈

charge

-3

mass

217.1098

reference

chebi:142706

InChIKey

RQMCNDRMPZBEOD-ZETCQYMHSA-K

InChI

InChI=1S/C7H8O8/c8-3(5(11)12)1-7(15,6(13)14)2-4(9)10/h15H,1-2H2,(H,9,10)(H,11,12)(H,13,14)/p-3/t7-/m0/s1

SMILES

O[C@](CC([O-])=O)(CC(=O)C([O-])=O)C([O-])=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:142706 chebi:142706	(2S)-2-hydroxy-4-oxobutane-1,2,4-tricarboxylate
CHEBI:142757 chebi:142757	(2S)-2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid (4S)-4-carboxy-4-hydroxy-2-oxoadipic acid (4S)-4-hydroxy-4-carboxymethyl-2-oxoglutaric acid
CHEBI:58075 chebi:58075	2-hydroxy-4-oxobutane-1,2,4-tricarboxylate
metacyc.compound:4-OH-4-ACETYL-2-OXOGLUTARATE metacycM:4-OH-4-ACETYL-2-OXOGLUTARATE	2-hydroxy-4-oxobutane-1,2,4-tricarboxylate 4-carboxy-4-hydroxy-2-ketoadipate 4-carboxy-4-hydroxy-2-oxoadipate 4-hydroxy-4-carboxymethyl-2-oxoglutarate 4-oxalocitramalate gamma-oxalocitramalate
lipidmaps:LMFA01050481 lipidmapsM:LMFA01050481	2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid
CHEBI:17250 chebi:17250	2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid 4-carboxy-4-hydroxy-2-oxoadipic acid 4-hydroxy-4-carboxymethyl-2-oxoglutaric acid
seed.compound:cpd02544 seedM:cpd02544	4-Carboxy-4-hydroxy-2-oxoadipate 2-Hydroxy-4-oxobutane-1,2,4-tricarboxylate 2-hydroxy-4-oxobutane-1,2,4-tricarboxylate 4-Hydroxy-4-carboxymethyl-2-oxoglutarate 4-carboxy-4-hydroxy-2-ketoadipate 4-carboxy-4-hydroxy-2-oxoadipate 4-hydroxy-4-carboxymethyl-2-oxoglutarate 4-oxalocitramalate gamma-oxalocitramalate
sabiork.compound:7090 sabiorkM:7090 kegg.compound:C04115 keggC:C04115	4-Carboxy-4-hydroxy-2-oxoadipate 2-Hydroxy-4-oxobutane-1,2,4-tricarboxylate 4-Hydroxy-4-carboxymethyl-2-oxoglutarate
chebi:1128 chebi:11585 chebi:1797 chebi:19611 chebi:20327 chebi:28186 keggC:M_C04115 seedM:M_cpd02544	secondary/obsolete/fantasy identifier