3-methyl-2-oxobutyric acid (Q2823217)

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chemical compound

• Α-Ketoisovaleric acid
• 2-Keto-3-methylbutyric acid
• 2-Ketovaline
• 2-Oxo-3-methylbutanoate
• 2-Oxoisopentanoate
• 2-Oxoisovalerate
• 3-Methyl-2-oxobutanoic acid
• 3-Methyl-2-oxobutyric acid
• alpha-Ketovaline
• Dimethylpyruvic acid
• 2-Oxoisovaleric acid
• 2-Oxo-3-methylbutyric acid
• alpha-oxoisovaleric acid
• 2-Oxo-3-methylbutanoic acid
• alpha-keto-isovaleric acid
• 2-Ketoisovaleric acid
• alpha-oxo-beta-methylbutyricacid
• Isopropylglyoxylic acid
• a-Oxo-b-methylbutyrate
• Ketovaline
• alpha-Keto-Isovalerate
• alpha-Ketoisovaleric acid
• 3-Methyl-2-oxobutinoate
• alpha-Keto-beta-Methylbutyrate
• a-Keto-Isovaleric acid
• a-Oxoisovalerate
• Isopropylglyoxylate
• 3-Methyl-2-oxo-Butyric acid
• a-Ketoisovalerate
• 2-Ketoisvaleric acid
• a-Oxoisovaleric acid
• 2-Ketoisovalerate
• a-Keto-b-Methylbutyrate
• a-Ketoisovaleric acid
• a-Keto-b-Methylbutyric acid
• alpha-Ketoisovalerate
• alpha-Oxoisovalerate
• 3-Methyl-2-oxo-Butyrate
• 3-Methyl-2-oxo-Butanoate
• 2-Keto-3-Methylbutyrate
• alpha-Oxo-beta-methylbutyric acid
• a-Oxo-b-methylbutyric acid
• 2-Oxo-3-methyl-butyrate
• 2-Oxo-3-methylbutyrate
• 3-Methyl-2-oxobutyrate
• a-Keto-Isovalerate
• 3-Methyl-2-oxobutinoic acid
• Dimethylpyruvate
• alpha-Oxo-beta-methylbutyrate
• alpha-Keto-beta-Methylbutyric acid
• 3-methyl-2-oxo-butanoic acid
• Alpha-ketoisovalerate

edit

Language	Label	Description	Also known as
English	3-methyl-2-oxobutyric acid	chemical compound	Α-Ketoisovaleric acid 2-Keto-3-methylbutyric acid 2-Ketovaline 2-Oxo-3-methylbutanoate 2-Oxoisopentanoate 2-Oxoisovalerate 3-Methyl-2-oxobutanoic acid 3-Methyl-2-oxobutyric acid alpha-Ketovaline Dimethylpyruvic acid 2-Oxoisovaleric acid 2-Oxo-3-methylbutyric acid alpha-oxoisovaleric acid 2-Oxo-3-methylbutanoic acid alpha-keto-isovaleric acid 2-Ketoisovaleric acid alpha-oxo-beta-methylbutyricacid Isopropylglyoxylic acid a-Oxo-b-methylbutyrate Ketovaline alpha-Keto-Isovalerate alpha-Ketoisovaleric acid 3-Methyl-2-oxobutinoate alpha-Keto-beta-Methylbutyrate a-Keto-Isovaleric acid a-Oxoisovalerate Isopropylglyoxylate 3-Methyl-2-oxo-Butyric acid a-Ketoisovalerate 2-Ketoisvaleric acid a-Oxoisovaleric acid 2-Ketoisovalerate a-Keto-b-Methylbutyrate a-Ketoisovaleric acid a-Keto-b-Methylbutyric acid alpha-Ketoisovalerate alpha-Oxoisovalerate 3-Methyl-2-oxo-Butyrate 3-Methyl-2-oxo-Butanoate 2-Keto-3-Methylbutyrate alpha-Oxo-beta-methylbutyric acid a-Oxo-b-methylbutyric acid 2-Oxo-3-methyl-butyrate 2-Oxo-3-methylbutyrate 3-Methyl-2-oxobutyrate a-Keto-Isovalerate 3-Methyl-2-oxobutinoic acid Dimethylpyruvate alpha-Oxo-beta-methylbutyrate alpha-Keto-beta-Methylbutyric acid 3-methyl-2-oxo-butanoic acid Alpha-ketoisovalerate

Statements

instance of

type of chemical entity

0 references

subclass of

biogenic acyclic ketone

0 references

branched chain fatty acids

0 references

chemical structure

3-Methyl-2-oxobutanoic-acid-2D-structure.svg
285 × 178; 9 KB

0 references

mass

116.047±0 dalton

1 reference

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 October 2016

tautomer of

2-Hydroxy-3-methylbut-2-enoic acid

1 reference

stated in

ChEBI release 2021-03-01

chemical formula

C₅H₈O₃

1 reference

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 November 2016

canonical SMILES

CC(C)C(=O)C(=O)O

1 reference

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 November 2016

found in taxon

Escherichia coli

1 reference

stated in

Antipolarity in the ilv Operon of Escherichia coli K-12

Homo sapiens

4 references

stated in

Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles

stated in

Recon 2.2: from reconstruction to model of human metabolism

stated in

A community-driven global reconstruction of human metabolism.

stated in

Blood levels of branched-chain alpha-keto acids in uremia: effect of an oral glucose tolerance test

Pyricularia oryzae

1 reference

stated in

ACCUMULATION OF DIMETHYLPYRUVIC ACID IN BIOTIN-DEFICIENT CULTURE OF PIRICULARIA ORYZAE

Aloe africana

1 reference

stated in

Aloe ferox leaf gel phytochemical content, antioxidant capacity, and possible health benefits

Caenorhabditis elegans

1 reference

stated in

Modeling Meets Metabolomics-The WormJam Consensus Model as Basis for Metabolic Studies in the Model Organism

Phaseolus vulgaris

1 reference

stated in

Metabolomics and Transcriptomics Identify Multiple Downstream Targets of Paraburkholderia phymatum σ54 During Symbiosis with Phaseolus vulgaris.

Saccharomyces cerevisiae

1 reference

stated in

An investigation of the metabolism of valine to isobutyl alcohol in Saccharomyces cerevisiae

subject has role

primary metabolite

1 reference

stated in

Reactome

reference URL

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

Commons category

Alpha-ketoisovaleric acid

0 references

Identifiers

InChI

InChI=1S/C5H8O3/c1-3(2)4(6)5(7)8/h3H,1-2H3,(H,7,8)

1 reference

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 November 2016

InChIKey

QHKABHOOEWYVLI-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 November 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

759-05-7

2 references

stated in

Global Substance Registration System

UNII

34P71D50E0

language of work or name

English

title

3-methyl-2-oxobutyric acid (English)

retrieved

19 November 2016

InChIKey

QHKABHOOEWYVLI-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=759-05-7

ChemSpider ID

48

1 reference

stated in

ChemSpider

ChemSpider ID

48

language of work or name

English

title

alpha-Ketoisovaleric acid (English)

retrieved

19 November 2016

PubChem CID

49

1 reference

stated in

PubChem

PubChem CID

49

language of work or name

English

title

3-Methyl-2-oxobutanoic acid (English)

retrieved

19 November 2016

Reaxys registry number

1744951

1 reference

stated in

ChEBI

ChEBI ID

16530

language of work or name

English

title

3-methyl-2-oxobutanoic acid (English)

retrieved

19 October 2016

ChEBI ID

16530

mapping relation type

exact match

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL146554

language of work or name

English

title

2-Oxoisovalerate (English)

retrieved

19 November 2016

ChEMBL ID

CHEMBL146554

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL146554

language of work or name

English

title

2-Oxoisovalerate (English)

retrieved

19 November 2016

UniChem compound ID

185808

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-GL_Sciences_Inc-GLS00033

0 references

MSBNK-GL_Sciences_Inc-GLS00034

0 references

MSBNK-Metabolon-MT000053

0 references

MSBNK-Osaka_Univ-OUF00289

0 references

MSBNK-Osaka_Univ-OUF00290

0 references

MSBNK-Keio_Univ-KO001315

0 references

MSBNK-Keio_Univ-KO001316

0 references

MSBNK-Keio_Univ-KO001317

0 references

MSBNK-Keio_Univ-KO001318

0 references

SPLASH

splash10-0f79-5920000000-759a2f01b4f52767ade2

0 references

splash10-014i-0900000000-9993174a7b1801b90ddb

0 references

splash10-00xr-9500000000-1a58c6a6b4f5477dabdd

0 references

splash10-00di-9000000000-75058f27a2178b9cf121

0 references

splash10-0006-9000000000-cc4465a47e663be66df5

0 references

splash10-00di-9100000000-19511890852fce513a02

0 references

splash10-000i-9500000000-ff936b879a69b5d118f8

0 references

splash10-000i-8920000000-e37b37d64d43dcf763f0

0 references

splash10-014i-0900000000-3a1141873a28ad0bcfd0

0 references

splash10-000i-7900000000-7e325567183fb56996d5

0 references

splash10-0ufr-0930000000-be90b06add7135b4a539

0 references

splash10-0f79-9720000000-5d89487273e44ea61a68

0 references

splash10-000i-9000000000-10ab58a33e9ca7dbace0

0 references

splash10-000i-9000000000-ad51ff01c94b6046ad64

0 references

splash10-000i-9400000000-e3995acc4818a98d0f48

0 references

DSSTox substance ID

DTXSID6061078

1 reference

stated in

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID5047823

0 references

EC number

212-065-4

1 reference

stated in

Global Substance Registration System

UNII

34P71D50E0

language of work or name

English

title

3-methyl-2-oxobutyric acid (English)

retrieved

19 November 2016

ECHA Substance Infocard ID

100.010.969

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.010.969

retrieved

27 December 2018

title

3-methyl-2-oxobutyric acid (English)

quotation

CAS no.: 759-05-7 (English)

FL number

08.051

1 reference

quotation

CAS no.: 759-05-7 (English)

stated in

EFSA database

retrieved

23 January 2021

FL number

08.051

Cannabis Database ID

004783

1 reference

stated in

Cannabis Database

DrugBank ID

04074

1 reference

stated in

DrugBank

DrugBank ID

04074

language of work or name

English

title

Alpha-ketoisovalerate (English)

retrieved

19 November 2016

Human Metabolome Database ID

HMDB0000019

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

QHKABHOOEWYVLI-UHFFFAOYSA-N

KNApSAcK ID

C00007623

3 references

stated in

ChEBI

ChEBI ID

16530

language of work or name

English

title

3-methyl-2-oxobutanoic acid (English)

retrieved

19 October 2016

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

QHKABHOOEWYVLI-UHFFFAOYSA-N

UNII

34P71D50E0

1 reference

stated in

Global Substance Registration System

UNII

34P71D50E0

language of work or name

English

title

3-methyl-2-oxobutyric acid (English)

retrieved

19 November 2016

Natural Product Atlas ID

NPA002663

1 reference

based on heuristic

inferred from InChIKey

Probes And Drugs ID

PD006500

0 references

KEGG ID

C00141

1 reference

imported from Wikimedia project

English Wikipedia

LIPID MAPS ID

LMFA01020274

0 references

PDB ligand ID

KIV

0 references

Freebase ID

/m/0464xkw

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

JECFA number

631

1 reference

stated in

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)

retrieved

13 May 2021

Microsoft Academic ID

2777532039

0 references

PDB structure ID

1O68

1 reference

stated in

Protein Data Bank

PDB structure ID

1O68

language of work or name

English

title

1O68 (English)

retrieved

19 October 2016

4OV4

1 reference

stated in

Protein Data Bank

PDB structure ID

4OV4

language of work or name

English

title

4OV4 (English)

retrieved

19 October 2016

1SR9

1 reference

stated in

Protein Data Bank

PDB structure ID

1SR9

language of work or name

English

title

1SR9 (English)

retrieved

19 October 2016

3U6W

1 reference

stated in

Protein Data Bank

PDB structure ID

3U6W

language of work or name

English

title

3U6W (English)

retrieved

19 October 2016

1KTA

1 reference

stated in

Protein Data Bank

PDB structure ID

1KTA

language of work or name

English

title

1KTA (English)

retrieved

19 October 2016

1HJG

1 reference

stated in

Protein Data Bank

PDB structure ID

1HJG

language of work or name

English

title

1HJG (English)

retrieved

19 October 2016

 

Sitelinks

Wikipedia(7 entries)

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• enwiki Α-Ketoisovaleric acid
• frwiki Acide 3-méthyl-2-oxobutanoïque
• jawiki Α-ケトイソ吉草酸
• kowiki 알파-케토아이소발레르산
• shwiki Alfa-Ketoizovalerinska kiselina
• srwiki Alfa-Ketoizovalerinska kiselina
• zhwiki Α-酮异戊酸

Wikibooks(0 entries)

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Wikinews(0 entries)

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Wikiquote(0 entries)

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Wikisource(0 entries)

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Wikiversity(0 entries)

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Wikivoyage(0 entries)

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Wiktionary(0 entries)

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Multilingual sites(1 entry)

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• commonswiki Category:Alpha-ketoisovaleric acid

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