hexane-1,6-diamine (CHEBI:39618)

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ChEBI Name	hexane-1,6-diamine

ChEBI ID	CHEBI:39618

Definition	A C₆ alkane-α,ω-diamine.

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

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Formula

C6H16N2

Net Charge

Average Mass

116.20472

Monoisotopic Mass

116.13135

InChI

InChI=1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2

InChIKey

NAQMVNRVTILPCV-UHFFFAOYSA-N

SMILES

NCCCCCCN

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):	human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans.

ChEBI Ontology
Outgoing	hexane-1,6-diamine (CHEBI:39618) has parent hydride hexane (CHEBI:29021) hexane-1,6-diamine (CHEBI:39618) has role human xenobiotic metabolite (CHEBI:76967) hexane-1,6-diamine (CHEBI:39618) is a alkane-α,ω-diamine (CHEBI:35411)

Incoming	N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane (CHEBI:53649) has functional parent hexane-1,6-diamine (CHEBI:39618) N¹,N⁶-bis-DNCP-1,6-hexanediamine (CHEBI:63123) has functional parent hexane-1,6-diamine (CHEBI:39618)

IUPAC Name

hexane-1,6-diamine

Last Modified

03 March 2014