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3-oxoadipate

Properties

Image

Occurences in reactions

MNX_ID

MNXM716

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	7

formula

C₆H₆O₅

charge

-2

mass

158.02262

reference

InChIKey

RTGHRDFWYQHVFW-UHFFFAOYSA-L

InChI

InChI=1S/C6H8O5/c7-4(3-6(10)11)1-2-5(8)9/h1-3H2,(H,8,9)(H,10,11)/p-2

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15775 chebi:15775	3-oxoadipate 3-Keto-adipate 3-Oxoadipate 3-oxoadipate(2-) 3-oxohexanedioate
bigg.metabolite:3oxoadp biggM:3oxoadp envipath:...36e7c3d90c64 envipathM:...36e7c3d90c64	3-Oxoadipate
sabiork.compound:5272 sabiorkM:5272 kegg.compound:C00846 keggC:C00846	3-Oxoadipate 3-Keto-adipate 3-Oxoadipic acid
seed.compound:cpd00630 seedM:cpd00630	3-Oxoadipate 3-Keto-adipate 3-Oxoadipic acid 3-ketoadipate 3-oxoadipate 3oxadp beta-ketoadipate
hmdb:HMDB0000398	3-Oxoadipic acid 3-Keto-adipate 3-Keto-adipic acid 3-Ketoadipate 3-Ketoadipic 3-Ketoadipic acid 3-Oxoadipate 3-Oxoadipic acid, disodium salt 3-Oxohexanedioate 3-Oxohexanedioic acid 3-oxo-Adipate 3-oxoadipic acid 3-oxohexanedioic acid b-Ketoadipate b-Ketoadipic acid b-Oxoadipate b-Oxoadipic acid beta-Ketoadipate beta-Ketoadipic acid beta-Oxoadipate beta-Oxoadipic acid beta-ketoadipate beta-ketoadipic acid beta-oxoadipate beta-oxoadipic acid
lipidmaps:LMFA01170096 lipidmapsM:LMFA01170096	3-oxo-adipic acid 3-oxo-hexanedioic acid FA 6:2 O3
metacyc.compound:3-KETO-ADIPATE metacycM:3-KETO-ADIPATE	3-oxoadipate 3-ketoadipate beta-ketoadipate
CHEBI:37440 chebi:37440	3-oxoadipic acid 3-Keto-adipate 3-Oxoadipic acid 3-oxohexanedioic acid beta-Ketoadipic acid beta-Oxoadipic acid
envipath:...7be29db0cf20 envipathM:...7be29db0cf20	compound 42285
hmdb:HMDB00398 chebi:11870 chebi:1631 chebi:20162 biggM:M_3oxoadp keggC:M_C00846 seedM:M_cpd00630	secondary/obsolete/fantasy identifier