isonicotinic acid (Q410465)

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chemical compound

• p-pyridinecarboxylic acid
• gamma-pyridinecarboxylic acid
• gamma-picolinic acid
• 4-carboxypyridine
• 4-pyridinecarboxylic acid
• pyridine-4-carboxylic acid

edit

Language	Label	Description	Also known as
English	isonicotinic acid	chemical compound	p-pyridinecarboxylic acid gamma-pyridinecarboxylic acid gamma-picolinic acid 4-carboxypyridine 4-pyridinecarboxylic acid pyridine-4-carboxylic acid

Statements

instance of

type of chemical entity

0 references

subclass of

pyridine alkaloids

0 references

carboxylic acid

0 references

chemical structure

Isonicotinsäure.svg
152 × 223; 7 KB

1 reference

imported from Wikimedia project

German Wikipedia

mass

123.032 dalton

1 reference

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

chemical formula

C₆H₅NO₂

1 reference

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

canonical SMILES

C1=CN=CC=C1C(=O)O

1 reference

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

pKa

4.6±0.12

1 reference

stated in

Experimental determination of pKa values by use of NMR chemical shift

found in taxon

Chlamydomonas reinhardtii

1 reference

stated in

The response of Chlamydomonas reinhardtii to nitrogen deprivation: a systems biology analysis

Arabidopsis thaliana

2 references

stated in

AtMetExpress development: a phytochemical atlas of Arabidopsis development

stated in

Pyridine nucleotides induce changes in cytosolic pools of calcium in Arabidopsis

Aloe africana

1 reference

stated in

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

MCN code

2933.39.33

0 references

has part(s)

carbon

0 references

nitrogen

0 references

oxygen

0 references

hydrogen

0 references

Commons category

Isonicotinic acid

0 references

Identifiers

InChI

InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)

1 reference

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

55-22-1

2 references

stated in

ChEBI

ChEBI ID

6032

language of work or name

English

title

isonicotinic acid (English)

retrieved

5 October 2016

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=55-22-1

ChemSpider ID

5709

1 reference

stated in

ChemSpider

ChemSpider ID

5709

language of work or name

English

title

Isonicotinic acid (English)

retrieved

5 October 2016

PubChem CID

5922

2 references

stated in

PubChem

PubChem CID

5922

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

Reaxys registry number

109599

1 reference

stated in

ChEBI

ChEBI ID

6032

language of work or name

English

title

isonicotinic acid (English)

retrieved

5 October 2016

Gmelin number

68876

0 references

ChEBI ID

6032

mapping relation type

exact match

2 references

stated in

ChEBI

ChEBI ID

6032

language of work or name

English

title

isonicotinic acid (English)

retrieved

5 October 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)

ChEMBL ID

CHEMBL1203

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL1203

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

SureChEMBL ID

SCHEMBL1108

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

UniChem compound ID

507815

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-RIKEN-PR010171

0 references

MSBNK-RIKEN-PR100155

0 references

MSBNK-RIKEN-PR100156

0 references

MSBNK-RIKEN-PR100577

0 references

MSBNK-Kazusa-KZ000040

0 references

MSBNK-Kazusa-KZ000147

0 references

MSBNK-Keio_Univ-KO003192

0 references

MSBNK-Keio_Univ-KO003193

0 references

MSBNK-Keio_Univ-KO003194

0 references

MSBNK-Keio_Univ-KO003195

0 references

MSBNK-Keio_Univ-KO003196

0 references

SPLASH

splash10-0540-0900000000-0673678e5fc7980445bd

0 references

splash10-0ab9-0900000000-3f8ad29d172aa06e19c6

0 references

splash10-00di-4900000000-04ecd2ded01bc6f9b466

0 references

splash10-001j-9100000000-b7a02f2f133138354546

0 references

splash10-003r-9000000000-ee099e60544c0326fdb7

0 references

splash10-00os-9000020000-f6daab3d1a982cfd35ec

0 references

splash10-0569-5900000000-26eb2a99def38d4a22c8

0 references

splash10-00di-4900000000-c7fa977839a809bc26c9

0 references

splash10-003s-9100000000-187ccf119a0f683d93d0

0 references

splash10-004i-9300000000-5aefad19534388180436

0 references

splash10-00di-0900000000-8d9ca618fe4c2e0c0fb6

0 references

splash10-00di-1900000000-a6eb7bc3c24061eed51a

0 references

splash10-00e9-9500000000-d7dc2e6748984365e32e

0 references

splash10-0fh9-9100000000-1ca118e55f42eeccbb9d

0 references

splash10-00di-1900000000-08cf475ae637325b1d85

0 references

splash10-004i-9000000000-82b6ac3938d6f333063a

0 references

NMRShiftDB structure ID

30000650

1 reference

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

ZVG number

25830

1 reference

imported from Wikimedia project

German Wikipedia

DSSTox substance ID

DTXSID8020757

2 references

stated in

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

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID80757

0 references

NSC number

1483

0 references

EC number

200-228-2

1 reference

stated in

Global Substance Registration System

UNII

Y8SYN761TQ

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

ECHA Substance Infocard ID

100.000.208

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.000.208

retrieved

27 December 2018

title

Isonicotinic acid (English)

quotation

CAS no.: 55-22-1 (English)

UM-BBD compound ID

c1164

0 references

DrugBank ID

DB16884

1 reference

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0060665

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

KNApSAcK ID

C00062175

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

UNII

Y8SYN761TQ

2 references

stated in

Global Substance Registration System

UNII

Y8SYN761TQ

language of work or name

English

title

ISONICOTINIC ACID (English)

retrieved

5 October 2016

matched by identifier from

InChIKey

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

Probes And Drugs ID

PD124116

0 references

KEGG ID

C07446

1 reference

stated in

ChEBI

ChEBI ID

6032

language of work or name

English

title

isonicotinic acid (English)

retrieved

5 October 2016

PDB ligand ID

S3V

0 references

Freebase ID

/m/0dxqdn

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

KBpedia ID

IsonicotinicAcid

1 reference

stated in

KBpedia

retrieved

9 July 2020

Microsoft Academic ID

2777854368

0 references

OpenAlex ID

C2777854368

1 reference

stated in

OpenAlex

retrieved

26 January 2022

reference URL

https://docs.openalex.org/download-snapshot/snapshot-data-format

 

Sitelinks

Wikipedia(17 entries)

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• arwiki حمض الآيزونيكونيك
• azbwiki ایزونیکوتینیک اسید
• cswiki Kyselina izonikotinová
• dewiki Isonicotinsäure
• enwiki Isonicotinic acid
• fawiki ایزونیکوتینیک اسید
• fiwiki Isonikotiinihappo
• frwiki Acide isonicotinique
• jawiki イソニコチン酸
• kowiki 아이소니코틴산
• ptwiki Ácido isonicotínico
• rowiki Acid izonicotinic
• ruwiki Изоникотиновая кислота
• shwiki Izonikotinska kiselina
• srwiki Izonikotinska kiselina
• tawiki ஐசோநிகோடினிக் அமிலம்
• zhwiki 异烟酸

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)

edit

• commonswiki Category:Isonicotinic acid

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