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6-trans-piperamide-c-7-1

Name(s) 6-trans-piperamide-c-7-1
Scientific name(s) dtxsid501016732; mcule-6995679615; (e)-7-(benzo[d][1,3]dioxol-5-yl)-1-(pyrrolidin-1-yl)hept-6-en-1-one; 6-hepten-1-one, 7-(1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)-, (6e)-; pyrrolidine, 1-[(6e)-7-(1,3-benzodioxol-5-yl)-1-oxo-6-heptenyl]-; pyrrolidine, 1-[7-(1,3-benzodioxol-5-yl)-1-oxo-6-heptenyl]-, (e)-; (6e)-7-(2h-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)hept-6-en-1-one
Formula C18H23NO3
Molecular mass 301.3801
IUPAC name (E)-7-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylhept-6-en-1-one; (6e)-7-(2h-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)hept-6-en-1-one
INCHI InChI=1S/C18H23NO3/c20-18(19-11-5-6-12-19)8-4-2-1-3-7-15-9-10-16-17(13-15)22-14-21-16/h3,7,9-10,13H,1-2,4-6,8,11-12,14H2/b7-3+
SMILE O=C(CCCC\C=C\C1=CC=C2OCOC2=C1)N1CCCC1
CAS ID 117137-66-3
PubChem ID 10957591
DrugBank ID Not available
CHEBI ID Not available
Description 6-trans-piperamide-c-7-1 is a member of the class of compounds known as benzodioxoles. Benzodioxoles are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms. 6-trans-piperamide-c-7-1 is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 6-trans-piperamide-c-7-1 can be found in pepper (spice), which makes 6-trans-piperamide-c-7-1 a potential biomarker for the consumption of this food product.