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CHEBI:183388 - 3',4'-dimethyl-alpha-Pyrrolidinovalerophenone

ChEBI IDCHEBI:183388
ChEBI Name3',4'-dimethyl-alpha-Pyrrolidinovalerophenone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H25NO
Net Charge0
Average Mass259.393
Monoisotopic Mass259.19361
SMILESCCCC(C(=O)c1ccc(C)c(C)c1)N1CCCC1
InChIInChI=1S/C17H25NO/c1-4-7-16(18-10-5-6-11-18)17(19)15-9-8-13(2)14(3)12-15/h8-9,12,16H,4-7,10-11H2,1-3H3
InChIKeyIKKXRCRMSQZNLG-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)
3',4'-dimethyl-alpha-Pyrrolidinovalerophenone (CHEBI:183388) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-(3,4-dimethylphenyl)-2-pyrrolidin-1-ylpentan-1-one