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CHEBI:183691 - JWH 412 N-(5-hydroxypentyl) metabolite

ChEBI IDCHEBI:183691
ChEBI NameJWH 412 N-(5-hydroxypentyl) metabolite
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H22FNO2
Net Charge0
Average Mass375.443
Monoisotopic Mass375.16346
SMILESO=C(c1ccc(F)c2ccccc12)c1cn(CCCCCO)c2ccccc12
InChIInChI=1S/C24H22FNO2/c25-22-13-12-20(17-8-2-3-9-18(17)22)24(28)21-16-26(14-6-1-7-15-27)23-11-5-4-10-19(21)23/h2-5,8-13,16,27H,1,6-7,14-15H2
InChIKeyJIQKZFCDBLYORO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
JWH 412 N-(5-hydroxypentyl) metabolite (CHEBI:183691) is a indolecarboxamide (CHEBI:46921)
IUPAC Name 
(4-luoronaphthalen-1-yl)-[1-(5-hydroxypentyl)indol-3-yl]methanone
Manual XrefsDatabases
68004091ChemSpider