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prephenate

MNXM737314 is deprecated and replaced by MNXM737312

Properties

Image

Occurences in reactions

MNX_ID

MNXM737312

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	15

formula

C₁₀H₈O₆

charge

-2

mass

224.03319

reference

chebi:29934

InChIKey

FPWMCUPFBRFMLH-XGAOUMNUSA-L

InChI

InChI=1S/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)/p-2/t6-,10+

SMILES

O=C([O-])C(=O)C[C@]1(C(=O)[O-])C=C[C@@H](O)C=C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:29934 chebi:29934	prephenate (1s,4s)-1-(2-carboxylato-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylate (1s,4s)-prephenate(2-) cis-1-(2-carboxylato-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylate cis-prephenate
CHEBI:84387 chebi:84387	(1s,4s)-prephenic acid (1s,4s)-1-(2-carboxy-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid Prephenic acid, cis cis-1-(2-carboxy-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid cis-1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid cis-prephenic acid
bigg.metabolite:pphn biggM:pphn SLM:000485365 slm:000485365	Prephenate
hmdb:HMDB0012283	Prephenate (1S,4S)-Prephenate (1s,4s)-1-(2-carboxy-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid 1-Carboxy-4-hydroxy-2,5-cyclohexadiene-1-pyruvic acid 1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid 1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propionic acid PPA PREPHENate Prephenate, cis Prephenic acid Prephenic acid, cis cis-1-Carboxy-4-hydroxy-a-oxo-2,5-cyclohexadiene-1-propanoate cis-1-Carboxy-4-hydroxy-a-oxo-2,5-cyclohexadiene-1-propanoic acid cis-1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoate cis-1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid cis-1-Carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propionic acid cis-Prephenate cis-Prephenic acid prephenic acid
sabiork.compound:1995 sabiorkM:1995 kegg.compound:C00254 keggC:C00254	Prephenate Prephenic acid
seed.compound:cpd00219 seedM:cpd00219	Prephenate Prephenic acid pphn prephenate prephenate-phe prephenate-tyr
CHEBI:57852 chebi:57852	prephenate(2-) 1-(2-carboxylato-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylate prephenate prephenate dianion
metacyc.compound:PREPHENATE metacycM:PREPHENATE	prephenate Prephenic acid
CHEBI:16666 chebi:16666	prephenic acid 1-Carboxy-4-hydroxy-2,5-cyclohexadiene-1-pyruvic acid 1-carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid PREPHENIC ACID Prephenic acid
hmdb:HMDB12283 chebi:14884 chebi:26256 chebi:26257 chebi:45028 chebi:8399 biggM:M_pphn keggC:M_C00254 seedM:M_cpd00219	secondary/obsolete/fantasy identifier