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4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol

Properties

Image

Occurences in reactions

MNX_ID

MNXM4356

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	6

formula

C₁₀H₁₅N₃O₂

charge

mass

209.11643

reference

InChIKey

OGRXKBUCZFFSTL-UHFFFAOYSA-N

InChI

InChI=1S/C10H15N3O2/c1-13(12-15)7-3-5-10(14)9-4-2-6-11-8-9/h2,4,6,8,10,14H,3,5,7H2,1H3

SMILES

CN(CCCC(O)c1cccnc1)N=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:82569 chebi:82569	4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol 4-(methylnitrosamino)-1-(3-pyridyl)-1-butan-1-ol 4-(methylnitrosoamino)-1-(3-pyridyl)-1-butanol 4-[methyl(nitroso)amino]-1-(3-pyridyl)-1-butanol 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol N-[4-hydroxy-4-(pyridin-3-yl)butyl]-N-methylnitrous amide NNAL
hmdb:HMDB0041809	4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butan-1-ol 4-(Methylnitrosoamino)-1--(3-pyridyl)-1-butanol 4-(N-Methyl-N-nitrosamino)-1-(3-pyridyl)butan-1-ol 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol MNAPB CPD NNAL NNAL CPD
seed.compound:cpd20828 seedM:cpd20828	4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol NNAL
kegg.compound:C19574 keggC:C19574	4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol NNAL
metacyc.compound:CPD-21235 metacycM:CPD-21235	4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol NNAL
hmdb:HMDB41809 keggC:M_C19574 seedM:M_cpd20828	secondary/obsolete/fantasy identifier