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CHEBI:228422 - 2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)-2H-1,2,3,4-tetraazole

ChEBI IDCHEBI:228422
ChEBI Name2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)-2H-1,2,3,4-tetraazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18N4O3
Net Charge0
Average Mass326.356
Monoisotopic Mass326.13789
SMILESCOc1cc(-c2nnn(-c3ccc(C)cc3)n2)cc(OC)c1OC
InChIInChI=1S/C17H18N4O3/c1-11-5-7-13(8-6-11)21-19-17(18-20-21)12-9-14(22-2)16(24-4)15(10-12)23-3/h5-10H,1-4H3
InChIKeyFQVORQBUULWRRG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)-2H-1,2,3,4-tetraazole (CHEBI:228422) is a tetrazoles (CHEBI:35689)
IUPAC Name 
2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)tetrazole
Manual XrefsDatabases
2076522ChemSpider