1-[(2E,4E)-7-(3,4-methylenedioxyphenyl)-2,4-heptadienoyl]pyrrolidine (CHEBI:70095)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	1-[(2E,4E)-7-(3,4-methylenedioxyphenyl)-2,4-heptadienoyl]pyrrolidine

ChEBI ID	CHEBI:70095

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

C18H21NO3

Net Charge

Average Mass

299.36420

Monoisotopic Mass

299.15214

InChI

InChI=1S/C18H21NO3/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/h1-2,4,8-10,13H,3,5-7,11-12,14H2/b2-1+,8-4+

InChIKey

IODPUHWFWZSHCM-AIWOWGKTSA-N

SMILES

O=C(\C=C\C=C\CCc1ccc2OCOc2c1)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,4E)-7-(3,4-methylenedioxyphenyl)-2,4-heptadienoyl]pyrrolidine (CHEBI:70095) has role metabolite (CHEBI:25212) 1-[(2E,4E)-7-(3,4-methylenedioxyphenyl)-2,4-heptadienoyl]pyrrolidine (CHEBI:70095) 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:benzenoid aromatic compound(CHEBI:33836); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:carboxamide(CHEBI:37622); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic acid(CHEBI:33575); ISA:acetal(CHEBI:59769); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);