1-[(2E)-7-(3,4-methylenedioxyphenyl)-2-heptenoyl]pyrrolidine (CHEBI:70094)

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

ChEBI ID	CHEBI:70094

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

C18H23NO3

Net Charge

Average Mass

301.38010

Monoisotopic Mass

301.16779

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/h4,8-10,13H,1-3,5-7,11-12,14H2/b8-4+

InChIKey

AXDKDWWPOMVARR-XBXARRHUSA-N

SMILES

O=C(\C=C\CCCCc1ccc2OCOc2c1)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)-7-(3,4-methylenedioxyphenyl)-2-heptenoyl]pyrrolidine (CHEBI:70094) has role metabolite (CHEBI:25212) 1-[(2E)-7-(3,4-methylenedioxyphenyl)-2-heptenoyl]pyrrolidine (CHEBI:70094) 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);