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CHEBI:214243 - 3-hydroxy-8-((E)-10-hydroxy-10-methylpentenyl)-2,4-dimethyltetrahydropyranone

ChEBI IDCHEBI:214243
ChEBI Name3-hydroxy-8-((E)-10-hydroxy-10-methylpentenyl)-2,4-dimethyltetrahydropyranone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O4
Net Charge0
Average Mass242.315
Monoisotopic Mass242.15181
SMILESCCC(C)(O)/C=C/[C@H]1OC(=O)[C@H](C)[C@H](O)[C@@H]1C
InChIInChI=1S/C13H22O4/c1-5-13(4,16)7-6-10-8(2)11(14)9(3)12(15)17-10/h6-11,14,16H,5H2,1-4H3/b7-6+/t8-,9-,10-,11-,13?/m1/s1
InChIKeyGIMCNFHSLMRMLR-YAOZRLOFSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (23578961)
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy-8-((E)-10-hydroxy-10-methylpentenyl)-2,4-dimethyltetrahydropyranone (CHEBI:214243) is a δ-lactone (CHEBI:18946)
IUPAC Name 
(3R,4R,5S,6R)-4-hydroxy-6-[(E)-3-hydroxy-3-methylpent-1-enyl]-3,5-dimethyloxan-2-one
Manual XrefsDatabases
78443414ChemSpider