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heteropyrithiamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM4226

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₁H₁₃N₄

charge

mass

201.11347

reference

InChIKey

SPQICHFDXHERAC-UHFFFAOYSA-N

InChI

InChI=1S/C11H13N4/c1-9-13-7-10(11(12)14-9)8-15-5-3-2-4-6-15/h2-7H,8H2,1H3,(H2,12,13,14)/q+1

SMILES

Cc1ncc(C[n+]2ccccc2)c(N)n1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:11222 chebi:11222	heteropyrithiamine 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium Heteropyrithiamine
kegg.compound:C02691 keggC:C02691	Heteropyrithiamine 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium
seed.compound:cpd01745 seedM:cpd01745	Heteropyrithiamine 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium heteropyrithiamine
metacyc.compound:CPD-1826 metacycM:CPD-1826	heteropyrithiamine
keggC:M_C02691 seedM:M_cpd01745	secondary/obsolete/fantasy identifier