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CHEBI:192161 - Desacetyllaurenobiolide

ChEBI IDCHEBI:192161
ChEBI NameDesacetyllaurenobiolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESC=C1C(=O)OC2C/C(C)=C\CC/C(C)=C\C(O)C12
InChIInChI=1S/C15H20O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h6-7,12-14,16H,3-5,8H2,1-2H3/b9-7-,10-6-
InChIKeyFRDLPOYYWWRSPZ-ZVEIMFCASA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
Desacetyllaurenobiolide (CHEBI:192161) is a germacranolide (CHEBI:73011)
IUPAC Name 
(5Z,9Z)-4-hydroxy-6,10-dimethyl-3-methylidene-3a,4,7,8,11,11a-hexahydrocyclodeca[b]uran-2-one
Manual XrefsDatabases
35014242ChemSpider
HMDB0036770HMDB