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CHEBI:216889 - Talaromyolide E

ChEBI IDCHEBI:216889
ChEBI NameTalaromyolide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H34O9
Net Charge0
Average Mass502.560
Monoisotopic Mass502.22028
SMILESCC(=O)O[C@@H]1c2c3c(cc(O)c2C(=O)O[C@@H]1C)O[C@]1(C)CC[C@]2(O)O[C@@]4(C(C)C)CC[C@]2(C)[C@]1(C3)O4
InChIInChI=1S/C27H34O9/c1-13(2)25-9-7-23(5)26(35-25)12-16-18(34-24(26,6)8-10-27(23,31)36-25)11-17(29)20-19(16)21(33-15(4)28)14(3)32-22(20)30/h11,13-14,21,29,31H,7-10,12H2,1-6H3/t14-,21+,23-,24-,25-,26+,27+/m1/s1
InChIKeySAKCFCRZWYVYFS-GBIFMYLOSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - DOI (10.1016/j.tet.2020.131349)
ChEBI Ontology
Outgoing Relation(s)
Talaromyolide E (CHEBI:216889) is a xanthenes (CHEBI:38835)
IUPAC Name 
[(1S,5R,6R,14R,17S,19R,22R)-10,17-dihydroxy-6,14,22-trimethyl-8-oxo-19-propan-2-yl-7,13,18,23-tetraoxahexacyclo[17.3.1.01,14.03,12.04,9.017,22]tricosa-3(12),4(9),10-trien-5-yl] acetate