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CHEBI:227115 - Talaromycesone B

ChEBI IDCHEBI:227115
ChEBI NameTalaromycesone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H18O10
Net Charge0
Average Mass502.431
Monoisotopic Mass502.09000
SMILESCC(=O)O[C@@H]1[C@@H]2C(=O)c3c(C)cc(O)c4c3C1(COC4=O)c1c(O)c3c4c(c(O)cc(C)c4c12)C(=O)O3
InChIInChI=1S/C27H18O10/c1-7-4-10(29)14-17-12(7)16-18-21(31)13-8(2)5-11(30)15-19(13)27(6-35-25(15)33,24(18)36-9(3)28)20(16)22(32)23(17)37-26(14)34/h4-5,18,24,29-30,32H,6H2,1-3H3/t18-,24+,27?/m0/s1
InChIKeyYDWARJNQPDMOTF-UWXRRGKQSA-N
Species of MetaboliteComponentSourceComments
Talaromycesspecies (ncbitaxon:1707706) - PubMed (25108548)
ChEBI Ontology
Outgoing Relation(s)
Talaromycesone B (CHEBI:227115) is a organic tricyclic compound (CHEBI:51959)
IUPAC Name 
[(13R,23R)-3,8,18-trihydroxy-10,16-dimethyl-6,14,20-trioxo-5,21-dioxaheptacyclo[11.9.1.11,15.14,7.02,12.011,25.019,24]pentacosa-2(12),3,7,9,11(25),15(24),16,18-octaen-23-yl] acetate
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40256709ChemSpider