EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:175674 - Dukunolide D

ChEBI IDCHEBI:175674
ChEBI NameDukunolide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O8
Net Charge0
Average Mass468.502
Monoisotopic Mass468.17842
SMILESCC1(C)C(=O)C2(O)CC3=CCCC4(C)C3=C(C(=O)OC4c3ccoc3)C2(O)C2(C)OC(=O)CC12
InChIInChI=1S/C26H28O8/c1-22(2)15-10-16(27)34-24(15,4)26(31)18-17-13(11-25(26,30)21(22)29)6-5-8-23(17,3)19(33-20(18)28)14-7-9-32-12-14/h6-7,9,12,15,19,30-31H,5,8,10-11H2,1-4H3
InChIKeyWUQGZJQZKDLECQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Dukunolide D (CHEBI:175674) is a organic heterotricyclic compound (CHEBI:26979)
Dukunolide D (CHEBI:175674) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
17-(uran-3-yl)-2,10-dihydroxy-3,8,8,16-tetramethyl-4,18-dioxapentacyclo[10.7.1.02,10.03,7.016,20]icosa-1(20),12-diene-5,9,19-trione
Manual XrefsDatabases
35014007ChemSpider
HMDB0035732HMDB