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CHEBI:205612 - Bacillosporin C

ChEBI IDCHEBI:205612
ChEBI NameBacillosporin C
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SubmitterMetaboLights
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FormulaC26H18O10
Net Charge0
Average Mass490.420
Monoisotopic Mass490.09000
SMILESCc1cc(O)c2c3c1C(=O)C[C@]1(O)Oc4c(c(O)c5c6c(c(O)cc(C)c46)C(=O)OC5)[C@]31COC2=O
InChIInChI=1S/C26H18O10/c1-8-3-12(28)18-19-14(8)13(29)5-26(33)25(19,7-35-24(18)32)20-21(30)10-6-34-23(31)17-11(27)4-9(2)15(16(10)17)22(20)36-26/h3-4,27-28,30,33H,5-7H2,1-2H3/t25-,26-/m0/s1
InChIKeyKHBPWHLZTSXJPH-UIOOFZCWSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - DOI (10.1039/c6ra17087k)
ChEBI Ontology
Outgoing Relation(s)
Bacillosporin C (CHEBI:205612) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(1S,15S)-3,9,15,21-tetrahydroxy-11,19-dimethyl-6,14,24-trioxaheptacyclo[16.7.1.14,8.01,15.02,13.022,26.012,27]heptacosa-2,4(27),8,10,12,18(26),19,21-octaene-7,17,23-trione
Manual XrefsDatabases
68004043ChemSpider