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CHEBI:225292 - Tornabeatin D

ChEBI IDCHEBI:225292
ChEBI NameTornabeatin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H40O3
Net Charge0
Average Mass352.559
Monoisotopic Mass352.29775
SMILESCCCCCCCCCCCCCCC/C=C1/C[C@](C)(CO)OC1=O
InChIInChI=1S/C22H40O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18-22(2,19-23)25-21(20)24/h17,23H,3-16,18-19H2,1-2H3/b20-17-/t22-/m1/s1
InChIKeyPUKKHYJSOBFENT-XPUAKXTGSA-N
Species of MetaboliteComponentSourceComments
Tornabea scutellifera (ncbitaxon:205647) - PubMed (15451325)
ChEBI Ontology
Outgoing Relation(s)
Tornabeatin D (CHEBI:225292) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(3Z,5R)-3-hexadecylidene-5-(hydroxymethyl)-5-methyloxolan-2-one
Manual XrefsDatabases
9454626ChemSpider