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CHEBI:210809 - Dhilirolide M

ChEBI IDCHEBI:210809
ChEBI NameDhilirolide M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O7
Net Charge0
Average Mass440.492
Monoisotopic Mass440.18350
SMILESC=C1[C@@]2(C)C[C@]3(C(C)=O)C4=CC(=O)OC(C)(C)C4=CC[C@]3(C)[C@]13C(=O)O[C@@H](C)[C@@]3(O)C2=O
InChIInChI=1S/C25H28O7/c1-12-21(6)11-23(13(2)26)16-10-17(27)32-20(4,5)15(16)8-9-22(23,7)24(12)19(29)31-14(3)25(24,30)18(21)28/h8,10,14,30H,1,9,11H2,2-7H3/t14-,21+,22-,23-,24+,25+/m0/s1
InChIKeyNCCIBFYSFDVNGE-VMLRTVRNSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - PubMed (24684453)
ChEBI Ontology
Outgoing Relation(s)
Dhilirolide M (CHEBI:210809) is a organic heterotricyclic compound (CHEBI:26979)
Dhilirolide M (CHEBI:210809) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,2S,11R,13R,15R,16S)-11-acetyl-15-hydroxy-2,6,6,13,16-pentamethyl-19-methylidene-7,17-dioxapentacyclo[11.5.1.01,15.02,11.05,10]nonadeca-4,9-diene-8,14,18-trione
Manual XrefsDatabases
78440245ChemSpider