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CHEBI:183739 - AKB48 N-(5-Fluoropentyl) analog

ChEBI IDCHEBI:183739
ChEBI NameAKB48 N-(5-Fluoropentyl) analog
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30FN3O
Net Charge0
Average Mass383.511
Monoisotopic Mass383.23729
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCF)c2ccccc12
InChIInChI=1S/C23H30FN3O/c24-8-4-1-5-9-27-20-7-3-2-6-19(20)21(26-27)22(28)25-23-13-16-10-17(14-23)12-18(11-16)15-23/h2-3,6-7,16-18H,1,4-5,8-15H2,(H,25,28)
InChIKeyUCMFSGVIEPXYIV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
AKB48 N-(5-Fluoropentyl) analog (CHEBI:183739) is a aromatic amide (CHEBI:62733)
AKB48 N-(5-Fluoropentyl) analog (CHEBI:183739) is a indazoles (CHEBI:38769)
IUPAC Name 
N-(1-adamantyl)-1-(5-luoropentyl)indazole-3-carboxamide
Manual XrefsDatabases
29339965ChemSpider
Registry NumbersSources
CAS:1400742-13-3ChemIDplus