Chemical Formula: C7H10O5

Chemical Formula C7H10O5

Found 45 metabolite its formula value is C7H10O5

Shikimic acid

Shikimic acid [3R-(3alpha,4alpha,5beta)]-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid

C7H10O5 (174.052821)


Shikimic acid is a cyclohexenecarboxylic acid that is cyclohex-1-ene-1-carboxylic acid substituted by hydroxy groups at positions 3, 4 and 5 (the 3R,4S,5R stereoisomer). It is an intermediate metabolite in plants and microorganisms. It has a role as an Escherichia coli metabolite, a Saccharomyces cerevisiae metabolite and a plant metabolite. It is a cyclohexenecarboxylic acid, a hydroxy monocarboxylic acid and an alpha,beta-unsaturated monocarboxylic acid. It is a conjugate acid of a shikimate. Shikimic acid is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Shikimic acid is a natural product found in Quercus mongolica, Populus tremula, and other organisms with data available. Shikimic acid is a metabolite found in or produced by Saccharomyces cerevisiae. A tri-hydroxy cyclohexene carboxylic acid important in biosynthesis of so many compounds that the shikimate pathway is named after it. Shikimic acid, more commonly known as its anionic form shikimate, is a cyclohexene, a cyclitol and a cyclohexanecarboxylic acid. It is an important biochemical intermediate in plants and microorganisms. Its name comes from the Japanese flower shikimi (the Japanese star anise, Illicium anisatum), from which it was first isolated. Shikimic acid is a precursor for: the aromatic amino acids phenylalanine and tyrosine; indole, indole derivatives and tryptophan; many alkaloids and other aromatic metabolites; tannins; and lignin. In pharmaceutical industry, shikimic acid from chinese star anise is used as a base material for production of Tamiflu (oseltamivir). Although shikimic acid is present in most autotrophic organisms, it is a biosynthetic intermediate and generally found in very low concentrations. A cyclohexenecarboxylic acid that is cyclohex-1-ene-1-carboxylic acid substituted by hydroxy groups at positions 3, 4 and 5 (the 3R,4S,5R stereoisomer). It is an intermediate metabolite in plants and microorganisms. Acquisition and generation of the data is financially supported in part by CREST/JST. CONFIDENCE standard compound; INTERNAL_ID 175 KEIO_ID S012 Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants. Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants.

   

2-Isopropyl-3-oxosuccinate

(2S)-2-(1-Methylethyl)-3-oxobutanedioic acid

C7H10O5 (174.052821)


2-Isopropyl-3-oxosuccinate belongs to the class of organic compounds known as short-chain keto acids and derivatives. These are keto acids with an alkyl chain that contains less than 6 carbon atoms. 2-Isopropyl-3-oxosuccinate is an extremely weak basic (essentially neutral) compound (based on its pKa). 2-Isopropyl-3-oxosuccinate exists in all living species, ranging from bacteria to humans. 2-Isopropyl-3-oxosuccinate has been detected, but not quantified in, several different foods, such as garden onion (var.), German camomiles, limes, cloud ear fungus, and citrus. This could make 2-isopropyl-3-oxosuccinate a potential biomarker for the consumption of these foods. 2-Isopropyl-3-oxosuccinate is an intermediate in leucine biosynthesis and can be generated from (2R,3S)-3-isopropylmalate. It is the third step in leucine biosynthesis after the fork from valine synthesis. It is an oxidative decarboxylation. Leucine biosynthesis involves a five-step conversion process starting with the valine precursor 2-keto-isovalerate. The final step in this pathway is catalyzed by two transaminases of broad specificity: branched-chain amino acid transferase (IlvE) and tyrosine aminotransferase (TyrB). In this pathway, 2-isopropyl-3-oxosuccinate is converted into 4-methyl-2-oxopentanoate via a spontaneous reaction (BioCyc).

   

2-Oxopimelate

2-Oxoheptanedionic acid

C7H10O5 (174.052821)


   

Valienone

SCHEMBL14409034

C7H10O5 (174.052821)


A member of the class of cyclohexenones that is cyclohex-2-en-1-one substituted by hydroxy groups at positions 4, 5 and 6, and by a hydroxymethyl group at position 3 (the 4R,5S,6R-diastereomer).

   

2-Methyl-3-oxoadipate

2-Methyl-3-oxoadipate

C7H10O5 (174.052821)


   

4-methyl-3-oxoadipate

4-methyl-3-oxoadipate

C7H10O5 (174.052821)


   

(R)-demethyl-4-deoxygadusol

Demethyl-4-deoxygadusol; 2,3,5-Trihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one

C7H10O5 (174.052821)


   

Dimethyl 2-oxoglutarate

1,5-dimethyl 2-oxopentanedioate

C7H10O5 (174.052821)


Dimethyl-2-oxoglutarate (MOG) is a key intermediate in the Krebs cycle and an important nitrogen transporter in the metabolic pathways in biological processes (PMID: 19766063).

   

2,6-dimethyl-trans-2-heptenoyl-CoA

1,5-Dimethyl 3-oxopentanedioic acid

C7H10O5 (174.052821)


2,6-dimethyl-trans-2-heptenoyl-CoA is also known as Dimethyl 1,3-acetonedicarboxylate or Dimethyl 3-oxopentanedioate. 2,6-dimethyl-trans-2-heptenoyl-CoA is considered to be soluble (in water) and acidic

   

Rancinamycin III

Rancinamycin III

C7H10O5 (174.052821)


   
   

1,3-Diacetoxyacetone

1,3-Diacetoxyacetone

C7H10O5 (174.052821)


   
   

3,4,5,6-Tetrahydroxy-2-methyl-2-cyclohexene-1-one

3,4,5,6-Tetrahydroxy-2-methyl-2-cyclohexene-1-one

C7H10O5 (174.052821)


   

1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one

1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one

C7H10O5 (174.052821)


   

Shikimic acid

(-)Shikimic acid

C7H10O5 (174.052821)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.054 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.052 Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants. Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants.

   

shikimate

Shikimic acid

C7H10O5 (174.052821)


Shikimic acid, also known as shikimate or 3,4,5-trihydroxy-1-cyclohexenecarboxylic acid, is a member of the class of compounds known as shikimic acids and derivatves. Shikimic acids and derivatves are cyclitols containing a cyclohexanecarboxylic acid substituted with three hydroxyl groups at positions 3, 4, and 5. Shikimic acid is soluble (in water) and a weakly acidic compound (based on its pKa). Shikimic acid can be found in a number of food items such as date, rocket salad, redcurrant, and poppy, which makes shikimic acid a potential biomarker for the consumption of these food products. Shikimic acid can be found primarily in blood and urine. Shikimic acid exists in all living species, ranging from bacteria to humans. Shikimic acid, more commonly known as its anionic form shikimate, is a cyclohexene, a cyclitol and a cyclohexanecarboxylic acid. It is an important biochemical metabolite in plants and microorganisms. Its name comes from the Japanese flower shikimi (シキミ, the Japanese star anise, Illicium anisatum), from which it was first isolated in 1885 by Johan Fredrik Eykman. The elucidation of its structure was made nearly 50 years later . Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants. Shikimic acid is a key metabolic intermediate of the aromatic amino acid biosynthesis pathway, found in microbes and plants.

   

6,7-dihydroxy-4-oxo-2-heptenoic acid

2-Heptenoic acid, 6,7-dihydroxy-4-oxo-

C7H10O5 (174.052821)


   

3-oxopimelic acid

3-Ketoheptanedioic acid

C7H10O5 (174.052821)


   

FA 7:2;O3

2-Heptenoic acid, 6,7-dihydroxy-4-oxo-

C7H10O5 (174.052821)


   

(R)-(-)-1-METHYL-3-PHENYLPROPYLAMINE

(R)-(-)-1-METHYL-3-PHENYLPROPYLAMINE

C7H10O5 (174.052821)


   

mono(2-methoxyethyl)ester

mono(2-methoxyethyl)ester

C7H10O5 (174.052821)


   

Tetrahydro-4H-pyran-4,4-dicarboxylic acid

Tetrahydro-4H-pyran-4,4-dicarboxylic acid

C7H10O5 (174.052821)


   

2,5-Furandione - 1,2-propanediol (1:1)

2,5-Furandione - 1,2-propanediol (1:1)

C7H10O5 (174.052821)


   

Dimethyl (methoxymethylene)malonate

Dimethyl (methoxymethylene)malonate

C7H10O5 (174.052821)


   

2-Propanone,1,3-bis(acetyloxy)-

2-Propanone,1,3-bis(acetyloxy)-

C7H10O5 (174.052821)


   

4-Oxoheptanedioic acid

4-Oxoheptanedioic acid

C7H10O5 (174.052821)


   

1,3-Dioxolane-4-acetic acid,2,2-dimethyl-5-oxo-

1,3-Dioxolane-4-acetic acid,2,2-dimethyl-5-oxo-

C7H10O5 (174.052821)


   

L-Altro-6.7-dideoxy-hept-6-ynose

L-Altro-6.7-dideoxy-hept-6-ynose

C7H10O5 (174.052821)


   

2,3-Oxiranedicarboxylic acid, 2-Methyl-, diMethyl ester,(2R,3R)-rel-

2,3-Oxiranedicarboxylic acid, 2-Methyl-, diMethyl ester,(2R,3R)-rel-

C7H10O5 (174.052821)


   

Diethyl ketomalonate

Diethyl ketomalonate

C7H10O5 (174.052821)


   

(S)-2-(2,2-Dimethyl-5-oxo-1,3-dioxolan-4-yl)acetic acid

(S)-2-(2,2-Dimethyl-5-oxo-1,3-dioxolan-4-yl)acetic acid

C7H10O5 (174.052821)


   

3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid

3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid

C7H10O5 (174.052821)


A cyclohexenecarboxylic acid that is 1-cyclohexene-1-carboxylic acid carrying three hydroxy substituents at positions 3, 4 and 5.

   

2,3-Anhydro-quinic acid

2,3-Anhydro-quinic acid

C7H10O5 (174.052821)


   

(S)-demethyl-4-deoxygadusol

(S)-demethyl-4-deoxygadusol

C7H10O5 (174.052821)


   

5-Hydroxy-4,6-dioxyheptanoic acid

5-Hydroxy-4,6-dioxyheptanoic acid

C7H10O5 (174.052821)


   

(2S)-2-Isopropyl-3-oxosuccinate

(2S)-2-Isopropyl-3-oxosuccinate

C7H10O5 (174.052821)


   

(2S)-2-isopropylmalate(2-)

(2S)-2-isopropylmalate(2-)

C7H10O5 (174.052821)


A 2-isopropylmalate(2-) with S-configuration at the chiral centre.

   

Dimethyl 3-oxoglutarate

Dimethyl 3-oxopentanedioate

C7H10O5 (174.052821)


   

Dimethyl 2-oxoglutarate

Dimethyl 2-oxopentanedioate

C7H10O5 (174.052821)


   

2-Isopropylmalate(2-)

2-Isopropylmalate(2-)

C7H10O5 (174.052821)


A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of 2-isopropylmalic acid.

   

3-Ketoheptanedioic acid

3-Ketoheptanedioic acid

C7H10O5 (174.052821)


   

(2R,3S)-3-isopropylmalate(2-)

(2R,3S)-3-isopropylmalate(2-)

C7H10O5 (174.052821)


   

(2S)-2-Isopropyl-3-oxosuccinic acid

(2S)-2-Isopropyl-3-oxosuccinic acid

C7H10O5 (174.052821)


An oxo dicarboxylic acid that is 2-ketosuccinic acid (oxalacetic acid) in which the 3-pro-S hydrogen is substituted by an isopropyl group.

   

Isopropyloxosuccinate

Isopropyloxosuccinate

C7H10O5 (174.052821)