5-(1-hydroxybutyl)-4-methoxy-6-methyl-2H-pyran-2-one (CHEBI:210854)

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CHEBI:210854 - 5-(1-hydroxybutyl)-4-methoxy-6-methyl-2H-pyran-2-one

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ChEBI ID	CHEBI:210854
ChEBI Name	5-(1-hydroxybutyl)-4-methoxy-6-methyl-2H-pyran-2-one
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Submitter	MetaboLights
Downloads	Molfile

Formula	C11H16O4
Net Charge	0
Average Mass	212.245
Monoisotopic Mass	212.10486
SMILES	CCC[C@@H](O)c1c(OC)cc(=O)oc1C
InChI	InChI=1S/C11H16O4/c1-4-5-8(12)11-7(2)15-10(13)6-9(11)14-3/h6,8,12H,4-5H2,1-3H3/t8-/m1/s1
InChIKey	RFMLGGZXHGTKIG-MRVPVSSYSA-N

Species of Metabolite	Component	Source	Comments
Alternaria phragmospora (ncbitaxon:570713)	-	PubMed (27708462)

ChEBI Ontology

Outgoing Relation(s)
	5-(1-hydroxybutyl)-4-methoxy-6-methyl-2H-pyran-2-one (CHEBI:210854) is a pyranone (CHEBI:37963)

IUPAC Name
5-[(1R)-1-hydroxybutyl]-4-methoxy-6-methylpyran-2-one

Manual Xrefs	Databases
78440468	ChemSpider