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3-Propylmalate

Properties

Image

Occurences in reactions

MNX_ID

MNXM4348

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₇H₁₂O₅

charge

mass

176.06847

reference

InChIKey

LOLHYFQEDPGSHZ-AKGZTFGVSA-N

InChI

InChI=1S/C7H12O5/c1-2-3-4(6(9)10)5(8)7(11)12/h4-5,8H,2-3H2,1H3,(H,9,10)(H,11,12)/t4?,5-/m0/s1

SMILES

CCCC(C(=O)O)[C@H](O)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.compound:C02123 keggC:C02123	3-Propylmalate
seed.compound:cpd01436 seedM:cpd01436	3-Propylmalate 3-propylmalate
metacyc.compound:CPD-52 metacycM:CPD-52	3-propylmalate
CHEBI:15594 chebi:15594	3-propylmalate 2-hydroxy-3-propylbutanedioate 2-hydroxy-3-propylsuccinate 3-propylmalate(2-)
CHEBI:30850 chebi:30850	3-propylmalic acid 2-hydroxy-3-propylbutanedioic acid
lipidmaps:LMFA01170064 lipidmapsM:LMFA01170064	3-propylmalic acid 2-hydroxy-3-propylbutanedioic acid 3-propylmalic acid FA 7:1 O3
chebi:11887 chebi:1663 chebi:20196 chebi:20197 keggC:M_C02123 seedM:M_cpd01436	secondary/obsolete/fantasy identifier