(E)-aconitic acid (Q27104227)

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chemical compound

(1E)-1-propene-1,2,3-tricarboxylic acid
(E)-1-propene-1,2,3-tricarboxylic acid
(1E)1-Propene-1,2,3-tricarboxylic acid
(E)-Aconitic acid
trans-1-Propene-1,2,3-tricarboxylic acid
TRA
(1E)-Prop-1-ene-1,2,3-tricarboxylic
trans-Aconitate
(1E)1-Propene-1,2,3-tricarboxylate
trans-Propene-1,2,3-tricarboxylic acid
1-trans-Propene-1,2,3-tricarboxylic acid
1-Propene-1-trans-2,3-tricarboxylic acid
2-propyl-2-one-1,4-dicarboxylic but-2-ene

Language	Label	Description	Also known as
English	(E)-aconitic acid	chemical compound	(1E)-1-propene-1,2,3-tricarboxylic acid (E)-1-propene-1,2,3-tricarboxylic acid (1E)1-Propene-1,2,3-tricarboxylic acid (E)-Aconitic acid trans-1-Propene-1,2,3-tricarboxylic acid TRA (1E)-Prop-1-ene-1,2,3-tricarboxylic trans-Aconitate (1E)1-Propene-1,2,3-tricarboxylate trans-Propene-1,2,3-tricarboxylic acid 1-trans-Propene-1,2,3-tricarboxylic acid 1-Propene-1-trans-2,3-tricarboxylic acid 2-propyl-2-one-1,4-dicarboxylic but-2-ene

Statements

type of chemical entity

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(EZ)-aconitic acid

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chemical structure

Trans-aconitic acid.png
1,000 × 735; 31 KB

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174.016438±0 dalton

1 reference

language of work or name

trans-Aconitic acid (English)

5 October 2016

chemical formula

C₆H₆O₆

1 reference

language of work or name

trans-Aconitic acid (English)

19 November 2016

canonical SMILES

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

1 reference

language of work or name

trans-Aconitic acid (English)

19 November 2016

isomeric SMILES

C(/C(=C\C(=O)O)/C(=O)O)C(=O)O

1 reference

language of work or name

trans-Aconitic acid (English)

19 November 2016

Vaccinium macrocarpon

1 reference

Nitrogen Form and Solution pH Effect on Organic Acid Content of Cranberry Roots and Shoots

Aconitum japonicum

1 reference

[Studies on the non-alkaloidal constituents of Aconitum japonicum thunb]

Echinochloa oryzicola

1 reference

Isolation and Identification of trans-Aconitic Acid as the Antiffeedant in Barnyard Grass Against the Brown Planthopper, Nilaparvata lugens (STAL) (Hompotara : Delphacidae)

Echinochloa oryzoides

1 reference

Isolation and Identification of trans-Aconitic Acid as the Antiffeedant in Barnyard Grass Against the Brown Planthopper, Nilaparvata lugens (STAL) (Hompotara : Delphacidae)

Echinochloa phyllopogon

1 reference

Isolation and Identification of trans-Aconitic Acid as the Antiffeedant in Barnyard Grass Against the Brown Planthopper, Nilaparvata lugens (STAL) (Hompotara : Delphacidae)

1 reference

Mixtures of similarly acting compounds in Daphnia magna: from gene to metabolite and beyond.

Aconitum barbatum

1 reference

Chemical constituents of Aconitum barbatum var. puberulum

Adonis vernalis

1 reference

V. Ueber einige Bestandtheile der Adonis vernalis

Asarum europaeum

1 reference

The Content of trans-Aconitic Acid in Asarum europaeum L. Determined by Means of a Chromatogram Spectrophotometer

Fasciola hepatica

1 reference

Some Acids Belonging to the Citric Acid Cycle in the Liver Fluke, Fasciola hepatica, L.

Helinus integrifolius

1 reference

XVII.—Constituents of the leaves of Helinus ovatus

1 reference

XVII.—Constituents of the leaves of Helinus ovatus

1 reference

Sensory-guided decomposition of red currant juice (Ribes rubrum) and structure determination of key astringent compounds

Saccharum officinarum

1 reference

Seasonal changes of cis-aconitic and malic acid contents in sugarcane.

Stratiotes aloides

1 reference

Flavonoid glucuronides and a chromone from the aquatic macrophyte Stratiotes aloides

Capsicum annuum var. annuum

1 reference

Chemical assessment and antioxidant capacity of pepper (Capsicum annuum L.) seeds

Bacillus thuringiensis

1 reference

Genetic and Biochemical Characterization of a Gene Operon for trans-Aconitic Acid, a Novel Nematicide from Bacillus thuringiensis

Caenorhabditis elegans

1 reference

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

Aquarius grandiflorus

1 reference

Trans-Aconitic acid, glucosylflavones and hydroxycinnamoyltartaric acids from the leaves of Echinodorus grandiflorus ssp. aureus, a Brazilian medicinal plant

Identifiers

InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+

1 reference

language of work or name

trans-Aconitic acid (English)

19 November 2016

GTZCVFVGUGFEME-HNQUOIGGSA-N

2 references

language of work or name

trans-Aconitic acid (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

(E)-aconitic acid (English)

19 November 2016

GTZCVFVGUGFEME-HNQUOIGGSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=4023-65-8

1 reference

language of work or name

(E)-Aconitic Acid (English)

5 October 2016

2 references

language of work or name

trans-Aconitic acid (English)

19 November 2016

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

Reaxys registry number

1725830

1 reference

language of work or name

trans-aconitic acid (English)

5 October 2016

1606182

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mapping relation type

2 references

language of work or name

ACONITIC ACID (English)

19 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+

1 reference

language of work or name

ACONITIC ACID (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-RIKEN-PR100861

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MSBNK-Keio_Univ-KO000171

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MSBNK-Keio_Univ-KO000172

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MSBNK-Keio_Univ-KO000173

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MSBNK-Keio_Univ-KO000174

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MSBNK-Keio_Univ-KO000175

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splash10-000i-9100000000-b3ebe9a6fedcb9608872

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splash10-000i-9000000000-4f60fbd245c1d58cd7d5

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splash10-000l-9000000000-d36114a1c7a0318b1f7a

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splash10-0006-9000000000-f4ae4a72d5f2beed9106

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splash10-000i-9200000000-49eaf4d6558839930e52

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splash10-00fr-0900000000-d24dc14cab7abf6c9af8

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splash10-000i-9000000000-1aea219f3432b2873d4c

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splash10-0002-1930000000-1043e640a069e4ed3c64

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splash10-000f-9100000000-d4857c30b96cf4786dbe

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splash10-000i-9300000000-1f04239a9a7133f89d08

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splash10-000f-9000000000-49f5c2a7959cfbbbe09f

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splash10-000f-9100000000-814aded0eac117ddb550

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splash10-003s-3971000000-d4adfdbddf5dc3badb47

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DSSTox substance ID

2 references

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

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

DSSTOX compound identifier

0 references

0 references

1 reference

Global Substance Registration System

language of work or name

(E)-aconitic acid (English)

19 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

(E)-1-propene-1,2,3-tricarboxylic acid (English)

CAS no.: 4023-65-8 (English)

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

2 references

Global Substance Registration System

language of work or name

(E)-aconitic acid (English)

19 November 2016

matched by identifier from

GTZCVFVGUGFEME-HNQUOIGGSA-N

Probes And Drugs ID

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Sitelinks

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Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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