1,3-propanediamine (Q161498)

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chemical compound

• tn
• 1,3-propylenediamine
• 1,3-Diamino-N-propane
• a,w-Propanediamine
• 1,3-Trimethylenediamine
• 3-Aminopropylamine

edit

Language	Label	Description	Also known as
English	1,3-propanediamine	chemical compound	tn 1,3-propylenediamine 1,3-Diamino-N-propane a,w-Propanediamine 1,3-Trimethylenediamine 3-Aminopropylamine

Statements

instance of

type of chemical entity

0 references

subclass of

PA3 polyamine alkaloid

0 references

part of

trimethylenediamine metabolic process

subject has role

participant

1 reference

stated in

Gene Ontology release 2019-11-16

trimethylenediamine catabolic process

subject has role

reactant

1 reference

stated in

Gene Ontology release 2019-11-16

trimethylenediamine biosynthetic process

subject has role

product

1 reference

stated in

Gene Ontology release 2019-11-16

beta-alanine biosynthetic process via 1,3 diaminopropane

subject has role

reaction intermediate

1 reference

stated in

Gene Ontology release 2020-05-02

chemical structure

1,3-Diaminopropane.svg
754 × 155; 1 KB

1 reference

imported from Wikimedia project

German Wikipedia

mass

74.084 dalton

1 reference

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 October 2016

chemical formula

C₃H₁₀N₂

1 reference

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 November 2016

canonical SMILES

C(CN)CN

1 reference

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 November 2016

melting point

−12.0 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response

NFPA Health

3

NFPA Fire

3

NFPA Instability

0

1 reference

imported from Wikimedia project

English Wikipedia

found in taxon

Lyallia kerguelensis

1 reference

stated in

Amine distribution and content in several parts of the subantarctic endemic species Lyallia kerguelensis (Hectorellaceae)

Cyanidium caldarium

1 reference

stated in

Polyamines of unicellular thermoacidophilic red alga Cyanidium caldarium

Eichhornia crassipes

1 reference

stated in

Identification and determination of sym-homospermidine in roots of water hyacinth, Eichhornia crassipes SOLMS.

Homo sapiens

3 references

stated in

Recon 2.2: from reconstruction to model of human metabolism

stated in

A community-driven global reconstruction of human metabolism.

stated in

Analysis of polyamines as carbamoyl derivatives in urine and serum by liquid chromatography-tandem mass spectrometry.

Caenorhabditis elegans

1 reference

stated in

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

subject has role

primary metabolite

1 reference

stated in

Reactome

reference URL

https://plantreactome.gramene.org/PathwayBrowser/#/R-OSA-2744345&DTAB=MT

has part(s)

nitrogen

0 references

carbon

0 references

hydrogen

0 references

Commons category

1,3-Diaminopropane

0 references

Identifiers

InChI

InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2

1 reference

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 November 2016

InChIKey

XFNJVJPLKCPIBV-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 November 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

109-76-2

1 reference

stated in

Global Substance Registration System

UNII

CB3ISL56KG

language of work or name

English

title

1,3-propanediamine (English)

retrieved

19 November 2016

ChemSpider ID

415

1 reference

stated in

ChemSpider

ChemSpider ID

415

language of work or name

English

title

1,3-Diaminopropane (English)

retrieved

19 November 2016

PubChem CID

428

1 reference

stated in

PubChem

PubChem CID

428

language of work or name

English

title

1,3-diaminopropane (English)

retrieved

19 November 2016

Reaxys registry number

605277

1 reference

stated in

ChEBI

ChEBI ID

15725

language of work or name

English

title

trimethylenediamine (English)

retrieved

19 October 2016

Gmelin number

1298

0 references

ChEBI ID

15725

mapping relation type

exact match

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL174324

language of work or name

English

title

CHEMBL174324 (English)

retrieved

19 November 2016

ChEMBL ID

CHEMBL174324

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL174324

language of work or name

English

title

CHEMBL174324 (English)

retrieved

19 November 2016

UniChem compound ID

92917

1 reference

stated in

UniChem

MassBank accession ID

MSBNK-Osaka_Univ-OUF00001

0 references

MSBNK-RIKEN-PR010001

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP003994

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP007321

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP007418

0 references

MSBNK-Kazusa-KZ000002

0 references

MSBNK-Kazusa-KZ000092

0 references

MSBNK-Keio_Univ-KO002657

0 references

MSBNK-Keio_Univ-KO002658

0 references

MSBNK-Keio_Univ-KO002659

0 references

MSBNK-Keio_Univ-KO002660

0 references

MSBNK-Keio_Univ-KO002661

0 references

SPLASH

splash10-053r-9000000000-95ecfa758d5699a04f9f

0 references

splash10-004i-9000000000-aeecaf348c083323da27

0 references

splash10-00dr-1900000000-5d8fbabd14e52e72c81e

0 references

splash10-00di-1910000000-a06f00628b2c5d1b00d9

0 references

splash10-004i-9000000000-1d904fa654446f8e7cc9

0 references

splash10-0a4i-9000000000-ea81063cc5dad3d70e4a

0 references

splash10-0a4i-9000000000-8b74b5893bc8add3c780

0 references

splash10-0a4l-9100000000-dad850c9eb355f048f2d

0 references

splash10-0006-9100000000-85942617edb7fb706c9f

0 references

splash10-00di-1900000000-380b075ca78246d55dc0

0 references

splash10-00di-6910000000-aff47ff9c6e0a888ca86

0 references

splash10-004i-9000000000-e7cb20ba88bfed049229

0 references

splash10-056r-9000000000-dc07b280437065bdf15f

0 references

splash10-0a4i-9000000000-fbca6aff1ab296e0bf2c

0 references

splash10-056r-9000000000-b5f49a81e3ebf43b6cba

0 references

splash10-0a4i-9000000000-43fd46e5767cda06477d

0 references

splash10-00dr-2900000000-03807bd96e6c6edb1948

0 references

splash10-00dr-2900000000-4d07c816c8f74c70156f

0 references

splash10-001i-9000000000-f6bc23624268bb35a760

0 references

splash10-053u-9000000000-7bb459bade8978e3cba4

0 references

splash10-0a4i-9000000000-8df8541d3f928c3f42de

0 references

splash10-0a59-9000000000-8fe9c1c9a2f7a72fd871

0 references

splash10-00di-2910000000-48a829abd35cdd63a4f8

0 references

CAMEO Chemicals ID

20109

0 references

UN number

2922

1 reference

imported from Wikimedia project

English Wikipedia

RTECS number

TX6825000

1 reference

imported from Wikimedia project

English Wikipedia

ZVG number

491175

0 references

DSSTox substance ID

DTXSID1021906

1 reference

stated in

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

DSSTOX compound identifier

DTXCID301906

0 references

NSC number

8154

0 references

EC number

203-702-7

1 reference

stated in

Global Substance Registration System

UNII

CB3ISL56KG

language of work or name

English

title

1,3-propanediamine (English)

retrieved

19 November 2016

ECHA Substance Infocard ID

100.003.367

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.003.367

retrieved

27 December 2018

title

Trimethylenediamine (English)

quotation

CAS no.: 109-76-2 (English)

Cannabis Database ID

004779

1 reference

stated in

Cannabis Database

AICS Chemical ID (BEING DELETED)

2868

0 references

Human Metabolome Database ID

HMDB0000002

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

XFNJVJPLKCPIBV-UHFFFAOYSA-N

KNApSAcK ID

C00007404

3 references

stated in

ChEBI

ChEBI ID

15725

language of work or name

English

title

trimethylenediamine (English)

retrieved

19 October 2016

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

XFNJVJPLKCPIBV-UHFFFAOYSA-N

UNII

CB3ISL56KG

1 reference

stated in

Global Substance Registration System

UNII

CB3ISL56KG

language of work or name

English

title

1,3-propanediamine (English)

retrieved

19 November 2016

Probes And Drugs ID

PD099153

0 references

KEGG ID

C00986

1 reference

imported from Wikimedia project

English Wikipedia

PDB ligand ID

13D

0 references

Freebase ID

/m/05syhxk

1 reference

stated in

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID

2777592839

0 references

PDB structure ID

4ARY

1 reference

stated in

Protein Data Bank

PDB structure ID

4ARY

language of work or name

English

title

4ARY (English)

retrieved

19 October 2016

4ARX

1 reference

stated in

Protein Data Bank

PDB structure ID

4ARX

language of work or name

English

title

4ARX (English)

retrieved

19 October 2016

4XQC

1 reference

stated in

Protein Data Bank

PDB structure ID

4XQC

language of work or name

English

title

4XQC (English)

retrieved

19 October 2016

2F8W

1 reference

stated in

Protein Data Bank

PDB structure ID

2F8W

language of work or name

English

title

2F8W (English)

retrieved

19 October 2016

 

Sitelinks

Wikipedia(14 entries)

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• azbwiki ۱٬۳-دی‌آمینوپروپان
• cswiki 1,3-diaminopropan
• dewiki 1,3-Diaminopropan
• enwiki 1,3-Diaminopropane
• fawiki ۱٬۳-دی‌آمینوپروپان
• fiwiki Trimetyleenidiamiini
• huwiki 1,3-Diaminopropán
• itwiki 1,3-diamminopropano
• nlwiki 1,3-propaandiamine
• ptwiki Propano-1,3-diamina
• shwiki 1,3-Diaminopropan
• srwiki 1,3-Diaminopropan
• tawiki 1,3-ஈரமினோபுரோப்பேன்
• zhwiki 1,3-丙二胺

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:1,3-Diaminopropane

Retrieved from "https://www.wikidata.org/w/index.php?title=Q161498&oldid=2153248504"