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CHEBI:183693 - JWH 018 N-pentanoic acid metabolite

ChEBI IDCHEBI:183693
ChEBI NameJWH 018 N-pentanoic acid metabolite
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H21NO3
Net Charge0
Average Mass371.436
Monoisotopic Mass371.15214
SMILESO=C(O)CCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21
InChIInChI=1S/C24H21NO3/c26-23(27)14-5-6-15-25-16-21(19-11-3-4-13-22(19)25)24(28)20-12-7-9-17-8-1-2-10-18(17)20/h1-4,7-13,16H,5-6,14-15H2,(H,26,27)
InChIKeyBYIVGHIYNFQIJX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
ChEBI Ontology
Outgoing Relation(s)
JWH 018 N-pentanoic acid metabolite (CHEBI:183693) is a indolecarboxamide (CHEBI:46921)
IUPAC Name 
5-[3-(naphthalene-1-carbonyl)indol-1-yl]pentanoic acid
Manual XrefsDatabases
26458423ChemSpider