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CHEBI:209962 - Talaromyolide D

ChEBI IDCHEBI:209962
ChEBI NameTalaromyolide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34O5
Net Charge0
Average Mass414.542
Monoisotopic Mass414.24062
SMILESC[C@@H]1Cc2c3c(cc(O)c2C(=O)O1)O[C@]1(C)CCC[C@](C)([C@H]2C[C@@H](O)C2(C)C)[C@H]1C3
InChIInChI=1S/C25H34O5/c1-13-9-15-14-10-19-24(4,18-12-20(27)23(18,2)3)7-6-8-25(19,5)30-17(14)11-16(26)21(15)22(28)29-13/h11,13,18-20,26-27H,6-10,12H2,1-5H3/t13-,18+,19-,20-,24-,25-/m1/s1
InChIKeyKVWHDTKSQUQVHQ-HBGMBDIISA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - PubMed (31364857)
ChEBI Ontology
Outgoing Relation(s)
Talaromyolide D (CHEBI:209962) is a xanthenes (CHEBI:38835)
IUPAC Name 
(2R,7aR,11R,11aR)-5-hydroxy-11-[(1R,3R)-3-hydroxy-2,2-dimethylcyclobutyl]-2,7a,11-trimethyl-2,8,9,10,11a,12-hexahydro-1H-pyrano[4,3-a]xanthen-4-one
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78434499ChemSpider