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CHEBI:198741 - Dhilirolide N

ChEBI IDCHEBI:198741
ChEBI NameDhilirolide N
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H26O8
Net Charge0
Average Mass454.475
Monoisotopic Mass454.16277
SMILESC=C1[C@@]2(C)C[C@]3(C(C)=O)C4=CC(=O)OC(C)(C)[C@]45O[C@@]4(C2=O)[C@H](C)OC(=O)[C@@]14[C@@]3(C)CC5=O
InChIInChI=1S/C25H26O8/c1-11-20(6)10-22(12(2)26)14-8-16(28)32-19(4,5)25(14)15(27)9-21(22,7)23(11)18(30)31-13(3)24(23,33-25)17(20)29/h8,13H,1,9-10H2,2-7H3/t13-,20+,21-,22-,23+,24+,25-/m0/s1
InChIKeyIDKFYPBAOUXQTL-JECTXCMLSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - PubMed (24684453)
ChEBI Ontology
Outgoing Relation(s)
Dhilirolide N (CHEBI:198741) is a organic heterotricyclic compound (CHEBI:26979)
Dhilirolide N (CHEBI:198741) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,3R,5R,11R,14S,15R,18S)-5-acetyl-3,10,10,14,18-pentamethyl-20-methylidene-9,17,19-trioxahexacyclo[9.7.1.13,15.01,15.05,14.06,11]icos-6-ene-2,8,12,16-tetrone