MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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hexane-1,6-diamine

	Properties	Image
MNX_ID	MNXM56426
reference	chebi:39618
formula	C₆H₁₆N₂
global charge	0
mol weight	116.208
InChIKey	NAQMVNRVTILPCV-UHFFFAOYSA-N
InChI	InChI=1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2
SMILES	NCCCCCCN

MNX internals

InChI (mnx)	InChI=1/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2
SMILES (mnx)	[CH2:1]([CH2:2][CH2:4][CH2:6][NH2:8])[CH2:3][CH2:5][NH2:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:39618 chebi:39618 NAQMVNRVTILPCV-UHFFFAOYSA-N	hexane-1,6-diamine 1,6-diamino-n-hexane 1,6-diaminohexane 1,6-hexamethylenediamine 1,6-hexanediamine 1,6-hexylenediamine H2N(CH2)6NH2 HEX-NH2 HEXANE-1,6-DIAMINE HMDA diaminohexane hexamethylene diamine hexamethylenediamine hexylenediamine
sabiork.compound:22971 sabiorkM:22971 NAQMVNRVTILPCV-UHFFFAOYSA-N	1,6-Diaminohexane
hmdb:HMDB0244244 NAQMVNRVTILPCV-UHFFFAOYSA-N	1,6-Hexanediamine 1,6-Diamino-N-hexane 1,6-Diaminohexamethylene 1,6-Diaminohexane 1,6-Diaminohexane dihydrochloride 1,6-Diaminohexane dihydrochloride, 1-(11)C-labeled 1,6-Diaminohexane dihydrofluoride 1,6-Diaminohexane monohydrochloride 1,6-Hexamethylenediamine 1,6-Hexane diamine 1,6-Hexanediamine methanesulfonate 1,6-Hexylenediamine 1,6-diaminohexane Diaminohexane H2N(CH2)6nh2 HEX-NH2 HMDA HMDA CPD Hexamethyldiamine Hexamethylene diamine Hexamethylenediamine Hexane-1,6-diamine Hexylenediamine hexane-1,6-diamine
metacyc.compound:CPD-7992 metacycM:CPD-7992 seed.compound:cpd25003 seedM:cpd25003 NAQMVNRVTILPCV-UHFFFAOYSA-P	1,6-diaminohexane
envipath:...c8fb88126356 envipathM:...c8fb88126356 NAQMVNRVTILPCV-UHFFFAOYSA-N	compound 0067498
seedM:M_cpd25003	secondary/obsolete/fantasy identifier