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CHEBI:208598 - Libertalide E

ChEBI IDCHEBI:208598
ChEBI NameLibertalide E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O4
Net Charge0
Average Mass280.364
Monoisotopic Mass280.16746
SMILESC[C@@]1(O)CC[C@H]2[C@@H](C=C[C@@]3(C)OC(=O)C[C@H](O)[C@]23C)C1
InChIInChI=1S/C16H24O4/c1-14(19)6-5-11-10(9-14)4-7-15(2)16(11,3)12(17)8-13(18)20-15/h4,7,10-12,17,19H,5-6,8-9H2,1-3H3/t10-,11-,12-,14+,15+,16-/m0/s1
InChIKeyULPLFCQFWQHTEY-PFAZVANRSA-N
ChEBI Ontology
Outgoing Relation(s)
Libertalide E (CHEBI:208598) is a organic heterotricyclic compound (CHEBI:26979)
Libertalide E (CHEBI:208598) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1S,4aR,6aR,8R,10aS,10bS)-1,8-dihydroxy-4a,8,10b-trimethyl-2,6a,7,9,10,10a-hexahydro-1H-benzo[]chromen-3-one
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78439031ChemSpider