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CHEBI:231239 - N-((1R,2S,4S)-Bicyclo[2.2.1]heptan-2-yl)-9-methyl-9H-purin-6-amine

ChEBI IDCHEBI:231239
ChEBI NameN-((1R,2S,4S)-Bicyclo[2.2.1]heptan-2-yl)-9-methyl-9H-purin-6-amine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H17N5
Net Charge0
Average Mass243.314
Monoisotopic Mass243.14840
SMILESCn1cnc2c(N[C@H]3C[C@H]4CC[C@@H]3C4)ncnc21
InChIInChI=1S/C13H17N5/c1-18-7-16-11-12(14-6-15-13(11)18)17-10-5-8-2-3-9(10)4-8/h6-10H,2-5H2,1H3,(H,14,15,17)/t8-,9+,10-/m0/s1
InChIKeyMTQYIGCUBBMQCJ-AEJSXWLSSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
N-((1R,2S,4S)-Bicyclo[2.2.1]heptan-2-yl)-9-methyl-9H-purin-6-amine (CHEBI:231239) is a thiopurine (CHEBI:35666)
IUPAC Name 
N-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-9-methylpurin-6-amine
Manual XrefsDatabases
5293421ChemSpider