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CHEBI:205509 - 3-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-2H-furan-5-one

ChEBI IDCHEBI:205509
ChEBI Name3-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-2H-furan-5-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O5
Net Charge0
Average Mass368.514
Monoisotopic Mass368.25627
SMILESCC(C)CCCCCCCCCCCCC(=O)C1=C(O)[C@H](CO)OC1=O
InChIInChI=1S/C21H36O5/c1-16(2)13-11-9-7-5-3-4-6-8-10-12-14-17(23)19-20(24)18(15-22)26-21(19)25/h16,18,22,24H,3-15H2,1-2H3/t18-/m0/s1
InChIKeyLUFRNHLCWMAXIC-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Actinomyces (ncbitaxon:1654) - PubMed (8150707)
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-2H-furan-5-one (CHEBI:205509) is a butenolide (CHEBI:50523)
IUPAC Name 
3-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-2H-uran-5-one
Manual XrefsDatabases
78434825ChemSpider