1-[(2E,8E)-9-(3,4-methylenedioxyphenyl)-2,8-nonadienoyl]pyrrolidine (CHEBI:70096)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	1-[(2E,8E)-9-(3,4-methylenedioxyphenyl)-2,8-nonadienoyl]pyrrolidine

ChEBI ID	CHEBI:70096

Definition	A natural product found in Piper boehmeriaefolium.

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C20H25NO3

Net Charge

Average Mass

327.41740

Monoisotopic Mass

327.18344

InChI

InChI=1S/C20H25NO3/c22-20(21-13-7-8-14-21)10-6-4-2-1-3-5-9-17-11-12-18-19(15-17)24-16-23-18/h5-6,9-12,15H,1-4,7-8,13-14,16H2/b9-5+,10-6+

InChIKey

BYKNKNBUHGFXQF-NXZHAISVSA-N

SMILES

O=C(\C=C\CCCC\C=C\c1ccc2OCOc2c1)N1CCCC1

Metabolite of Species	Details
Piper boehmeriaefolium (NCBI:txid130389)	Found in whole plant (BTO:0001461). Methanolic extract of air-dried, powdered whole plant See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	1-[(2E,8E)-9-(3,4-methylenedioxyphenyl)-2,8-nonadienoyl]pyrrolidine (CHEBI:70096) has role metabolite (CHEBI:25212) 1-[(2E,8E)-9-(3,4-methylenedioxyphenyl)-2,8-nonadienoyl]pyrrolidine (CHEBI:70096) is a benzodioxoles (CHEBI:38298)

Citation	Type	Source
21158422	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:N-acylpyrrolidine(CHEBI:46766); ISA:styrenes(CHEBI:26799); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:carboxamide(CHEBI:37622); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:acetal(CHEBI:59769); ISA:carbonyl compound(CHEBI:36586);