caldopentamine (CHEBI:83546)

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ChEBI Name	caldopentamine

ChEBI ID	CHEBI:83546

Definition	A polyazaalkane that is the 1,5,9,13,17-pentaaza derivative of heptodecane.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C12H31N5

Net Charge

Average Mass

245.40800

Monoisotopic Mass

245.25795

InChI

InChI=1S/C12H31N5/c13-5-1-7-15-9-3-11-17-12-4-10-16-8-2-6-14/h15-17H,1-14H2

InChIKey

BELZJFWUNQWBES-UHFFFAOYSA-N

SMILES

NCCCNCCCNCCCNCCCN

Metabolite of Species	Details
Heterosigma akashiwo (NCBI:txid2829)	See: PubMed
Chattonella marina var. antiqua (NCBI:txid859642)	See: PubMed

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.

ChEBI Ontology
Outgoing	caldopentamine (CHEBI:83546) has role marine metabolite (CHEBI:76507) caldopentamine (CHEBI:83546) is a polyazaalkane (CHEBI:39474) caldopentamine (CHEBI:83546) is a primary amino compound (CHEBI:50994) caldopentamine (CHEBI:83546) is a secondary amino compound (CHEBI:50995) caldopentamine (CHEBI:83546) is conjugate base of caldopentamine(4+) (CHEBI:82769)

Incoming	caldopentamine(4+) (CHEBI:82769) is conjugate acid of caldopentamine (CHEBI:83546)

IUPAC Name

N-(3-aminopropyl)-N'-{3-[(3-aminopropyl)amino]propyl}propane-1,3-diamine

Synonyms	Sources
tetrapropylenepentamine	MetaCyc
Tetratrimethylenepentamine	ChemIDplus

Last Modified

29 October 2014