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CHEBI:212739 - Tricholactone

ChEBI IDCHEBI:212739
ChEBI NameTricholactone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22O4
Net Charge0
Average Mass254.326
Monoisotopic Mass254.15181
SMILESCOC1=CC(=O)O[C@@H]([C@H](C)C[C@H](C)CC(C)=O)C1
InChIInChI=1S/C14H22O4/c1-9(6-11(3)15)5-10(2)13-7-12(17-4)8-14(16)18-13/h8-10,13H,5-7H2,1-4H3/t9-,10+,13+/m0/s1
InChIKeyQUILGFVARLSNLK-OPQQBVKSSA-N
Species of MetaboliteComponentSourceComments
Trichodesmiumspecies (ncbitaxon:1207) - PubMed (30280904)
ChEBI Ontology
Outgoing Relation(s)
Tricholactone (CHEBI:212739) is a pyranone (CHEBI:37963)
IUPAC Name 
(2R)-4-methoxy-2-[(2R,4S)-4-methyl-6-oxoheptan-2-yl]-2,3-dihydropyran-6-one
Manual XrefsDatabases
70951833ChemSpider