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CHEBI:209942 - Talaromyolide A

ChEBI IDCHEBI:209942
ChEBI NameTalaromyolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O8
Net Charge0
Average Mass432.469
Monoisotopic Mass432.17842
SMILESCC(C)[C@@]12C[C@]3(C)[C@]4(Cc5c(cc(O)c6c5[C@@H](O)[C@@H](C)OC6=O)O[C@]4(C)C[C@]3(O)O1)O2
InChIInChI=1S/C23H28O8/c1-10(2)21-8-19(4)22(30-21)7-12-14(29-20(22,5)9-23(19,27)31-21)6-13(24)16-15(12)17(25)11(3)28-18(16)26/h6,10-11,17,24-25,27H,7-9H2,1-5H3/t11-,17+,19-,20-,21-,22+,23+/m1/s1
InChIKeyHMRARWPSVSGXMT-MCLOBCSCSA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - PubMed (31364857)
ChEBI Ontology
Outgoing Relation(s)
Talaromyolide A (CHEBI:209942) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(1S,5R,6R,14R,16S,18R,20R)-5,10,16-trihydroxy-6,14,20-trimethyl-18-propan-2-yl-7,13,17,21-tetraoxahexacyclo[16.2.1.01,14.03,12.04,9.016,20]henicosa-3(12),4(9),10-trien-8-one
Manual XrefsDatabases
78434500ChemSpider