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CHEBI:205621 - Asperolide E

ChEBI IDCHEBI:205621
ChEBI NameAsperolide E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18O5
Net Charge0
Average Mass290.315
Monoisotopic Mass290.11542
SMILESC[C@@]12[C@H](O)C=C[C@]3(C)C(=O)O[C@H](C=C4COC(=O)C[C@@H]41)[C@H]23
InChIInChI=1S/C16H18O5/c1-15-4-3-11(17)16(2)9-6-12(18)20-7-8(9)5-10(13(15)16)21-14(15)19/h3-5,9-11,13,17H,6-7H2,1-2H3/t9-,10+,11+,13-,15-,16-/m0/s1
InChIKeyOYLDDVDDTJAPFJ-GBEYQOMZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (27257768)
ChEBI Ontology
Outgoing Relation(s)
Asperolide E (CHEBI:205621) is a organic heterotricyclic compound (CHEBI:26979)
Asperolide E (CHEBI:205621) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,2S,9R,12S,15R,16R)-15-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-7,13-diene-4,11-dione
Manual XrefsDatabases
60597158ChemSpider