3-(3-methylbut-2-enyl)-4-(3-methylbut-2-enyloxy)quinolin-2(1H)-one (Structural isomer of Buchapine) (CHEBI:65536)

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ChEBI Name	3-(3-methylbut-2-enyl)-4-(3-methylbut-2-enyloxy)quinolin-2(1H)-one (Structural isomer of Buchapine)

ChEBI ID	CHEBI:65536

Definition	A natural product found in Haplophyllum tuberculatum and Euodia roxburghiana.

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

Supplier Information

Download	Molfile XML SDF

Formula

C19H23NO2

Net Charge

Average Mass

297.39140

Monoisotopic Mass

297.17288

InChI

InChI=1S/C19H23NO2/c1-13(2)9-10-16-18(22-12-11-14(3)4)15-7-5-6-8-17(15)20-19(16)21/h5-9,11H,10,12H2,1-4H3,(H,20,21)

InChIKey

YADLZLRNLRNTCM-UHFFFAOYSA-N

SMILES

CC(C)=CCOc1c(CC=C(C)C)c(=O)[nH]c2ccccc12

Metabolite of Species	Details
Euodia roxburghiana (IPNI:773124-1)	See: PubMed
Haplophyllum tuberculatum (NCBI:txid452784)	See: DOI

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	3-(3-methylbut-2-enyl)-4-(3-methylbut-2-enyloxy)quinolin-2(1H)-one (Structural isomer of Buchapine) (CHEBI:65536) has role metabolite (CHEBI:25212) 3-(3-methylbut-2-enyl)-4-(3-methylbut-2-enyloxy)quinolin-2(1H)-one (Structural isomer of Buchapine) (CHEBI:65536) is a quinolines (CHEBI:26513)

Citation	Type	Source
8778237	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:quinolines(CHEBI:26513); ISA:pyridone(CHEBI:38183); ISA:aromatic ether(CHEBI:35618); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:lactam(CHEBI:24995); ISA:organonitrogen compound(CHEBI:35352);