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CHEBI:179871 - Dukunolide B

ChEBI IDCHEBI:179871
ChEBI NameDukunolide B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H26O10
Net Charge0
Average Mass498.484
Monoisotopic Mass498.15260
SMILESCC12CCC3OC34CC3(O)C(=O)C(C)(C)C56OC5C(=O)OC6(C)C3(O)C(=C14)C(=O)OC2c1ccoc1
InChIInChI=1S/C26H26O10/c1-20(2)19(29)24(30)10-23-12(34-23)5-7-21(3)14(23)13(17(27)33-15(21)11-6-8-32-9-11)25(24,31)22(4)26(20)16(35-26)18(28)36-22/h6,8-9,12,15-16,30-31H,5,7,10H2,1-4H3
InChIKeyCDCHBVSDWNDPOE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Dukunolide B (CHEBI:179871) is a organic heterotricyclic compound (CHEBI:26979)
Dukunolide B (CHEBI:179871) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
16-(uran-3-yl)-3,12-dihydroxy-5,5,11,17-tetramethyl-7,10,15,21-tetraoxaheptacyclo[11.8.1.01,20.03,12.06,8.06,11.017,22]docos-13(22)-ene-4,9,14-trione
Manual XrefsDatabases
35013977ChemSpider
HMDB0035664HMDB