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CHEBI:203617 - Dhilirolide B

ChEBI IDCHEBI:203617
ChEBI NameDhilirolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O8
Net Charge0
Average Mass456.491
Monoisotopic Mass456.17842
SMILESC[C@@H]1OC(=O)C23C4(CO4)[C@@]4(C)CC5(C6=CC(=O)OC(C)(C)C6=CC[C@]25C)[C@@]2(C)OC13[C@@]4(O)O2
InChIInChI=1S/C25H28O8/c1-12-24-23(16(27)30-12)18(4)8-7-13-14(9-15(26)31-17(13,2)3)21(18)10-19(5,22(23)11-29-22)25(24,28)33-20(21,6)32-24/h7,9,12,28H,8,10-11H2,1-6H3/t12-,18-,19+,20-,21?,22?,23?,24?,25-/m0/s1
InChIKeyHKYMRYMDXIHYTJ-XQULWFFTSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - PubMed (21348535)
ChEBI Ontology
Outgoing Relation(s)
Dhilirolide B (CHEBI:203617) is a organic heterotricyclic compound (CHEBI:26979)
Dhilirolide B (CHEBI:203617) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(2S,11S,13R,14S,16S,19S)-14-hydroxy-2,6,6,13,16,19-hexamethylspiro[7,15,17,20-tetraoxaheptacyclo[11.8.1.01,18.02,11.05,10.011,16.014,18]docosa-4,9-diene-22,2'-oxirane]-8,21-dione