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(2S)-2-isopropyl-3-oxosuccinate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1602

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	5

formula

C₇H₈O₅

charge

-2

mass

172.13542

reference

chebi:17214

InChIKey

HIIZAGQWABAMRR-BYPYZUCNSA-L

InChI

InChI=1S/C7H10O5/c1-3(2)4(6(9)10)5(8)7(11)12/h3-4H,1-2H3,(H,9,10)(H,11,12)/p-2/t4-/m0/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17214 chebi:17214	(2S)-2-isopropyl-3-oxosuccinate (2S)-2-isopropyl-3-oxosuccinate(2-) (2S)-3-oxo-2-(propan-2-yl)butanedioate
kegg.compound:C04236 keggC:C04236	(2S)-2-Isopropyl-3-oxosuccinate 2-Oxo-4-methyl-3-carboxypentanoate 3-Carboxy-4-methyl-2-oxopentanoate
metacyc.compound:CPD-7100 metacycM:CPD-7100	(2S)-2-isopropyl-3-oxosuccinate 2-isopropyl-3-oxosuccinate
CHEBI:1467 chebi:1467	(2S)-2-isopropyl-3-oxosuccinic acid (2S)-2-(1-methylethyl)-3-oxobutanedioic acid (2S)-2-Isopropyl-3-oxosuccinate (2S)-3-oxo-2-(propan-2-yl)butanedioic acid 3-Carboxy-4-methyl-2-oxopentanoate
hmdb:HMDB0012149	2-Isopropyl-3-oxosuccinate (2S)-2-(1-Methylethyl)-3-oxobutanedioate (2S)-2-(1-Methylethyl)-3-oxobutanedioic acid (2S)-2-Isopropyl-3-oxosuccinate (2S)-2-Isopropyl-3-oxosuccinic acid (2S)-2-isopropyl-3-oxobutanedioic acid (2S)-3-oxo-2-(Propan-2-yl)butanedioate (2S)-3-oxo-2-(Propan-2-yl)butanedioic acid (3S)-2-oxo-3-(propan-2-yl)butanedioic acid 2-Isopropyl-3-oxosuccinic acid 2-oxo-4-Methyl-3-carboxypentanoate 2-oxo-4-Methyl-3-carboxypentanoic acid 3-Carboxy-4-methyl-2-oxopentanoate 3-Carboxy-4-methyl-2-oxopentanoic acid
seed.compound:cpd02605 seedM:cpd02605	2-isopropyl-3-oxosuccinate (2S)-2-Isopropyl-3-oxosuccinate (2S)-2-isopropyl-3-oxosuccinate 2-Oxo-4-methyl-3-carboxypentanoate 3-Carboxy-4-methyl-2-oxopentanoate 3c4mop
bigg.metabolite:3c4mop biggM:3c4mop	3-Carboxy-4-methyl-2-oxopentanoate
hmdb:HMDB12149 chebi:11765 chebi:19975 biggM:M_3c4mop keggC:M_C04236 seedM:M_cpd02605	secondary/obsolete/fantasy identifier