1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1,4-pentanedione (CHEBI:172447)

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CHEBI:172447 - 1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1,4-pentanedione

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ChEBI ID	CHEBI:172447
ChEBI Name	1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1,4-pentanedione
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H15NO2
Net Charge	0
Average Mass	205.257
Monoisotopic Mass	205.11028
SMILES	CC(=O)CCC(=O)c1ccc2n1CCC2
InChI	InChI=1S/C12H15NO2/c1-9(14)4-7-12(15)11-6-5-10-3-2-8-13(10)11/h5-6H,2-4,7-8H2,1H3
InChIKey	BDWPPPWPSZSWII-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	blood plasma (BTO:0000131)	MetaboLights (MTBLS2633)

ChEBI Ontology

Outgoing Relation(s)
	1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1,4-pentanedione (CHEBI:172447) is a pyrrolizines (CHEBI:38522)

IUPAC Name
1-(6,7-dihydro-5H-pyrrolizin-3-yl)pentane-1,4-dione

Manual Xrefs	Databases
HMDB0040046	HMDB
30777405	ChemSpider