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CHEBI:183709 - JWH-018 N-(3-methylbutyl) isomer

ChEBI IDCHEBI:183709
ChEBI NameJWH-018 N-(3-methylbutyl) isomer
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H23NO
Net Charge0
Average Mass341.454
Monoisotopic Mass341.17796
SMILESCC(C)CCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21
InChIInChI=1S/C24H23NO/c1-17(2)14-15-25-16-22(20-11-5-6-13-23(20)25)24(26)21-12-7-9-18-8-3-4-10-19(18)21/h3-13,16-17H,14-15H2,1-2H3
InChIKeyBBNUROBSKAJPGN-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-018 N-(3-methylbutyl) isomer (CHEBI:183709) is a indolecarboxamide (CHEBI:46921)
IUPAC Name 
[1-(3-methylbutyl)indol-3-yl]-naphthalen-1-ylmethanone
Manual XrefsDatabases
26458652ChemSpider