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CHEBI:185598 - 2-Heptylbenzothiazole

ChEBI IDCHEBI:185598
ChEBI Name2-Heptylbenzothiazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H19NS
Net Charge0
Average Mass233.380
Monoisotopic Mass233.12382
SMILESCCCCCCCc1nc2ccccc2s1
InChIInChI=1S/C14H19NS/c1-2-3-4-5-6-11-14-15-12-9-7-8-10-13(12)16-14/h7-10H,2-6,11H2,1H3
InChIKeySJZWEHXSUIPACF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
2-Heptylbenzothiazole (CHEBI:185598) is a benzothiazoles (CHEBI:37947)
IUPAC Name 
2-heptyl-1,3-benzothiazole
Manual XrefsDatabases
HMDB0040033HMDB
30777401ChemSpider
Registry NumbersSources
CAS:69938-51-8ChemIDplus