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CHEBI:205190 - Inonoblin B

ChEBI IDCHEBI:205190
ChEBI NameInonoblin B
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SubmitterMetaboLights
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FormulaC23H14O10
Net Charge0
Average Mass450.355
Monoisotopic Mass450.05870
SMILESCC(=O)[C@]1(O)C(c2cc3oc(=O)c4cc(O)c(O)cc4c3c(=O)o2)=Cc2cc(O)c(O)cc21
InChIInChI=1S/C23H14O10/c1-8(24)23(31)12-6-17(28)14(25)3-9(12)2-13(23)18-7-19-20(22(30)32-18)10-4-15(26)16(27)5-11(10)21(29)33-19/h2-7,25-28,31H,1H3/t23-/m1/s1
InChIKeyNITFEFGLVNCSOC-HSZRJFAPSA-N
Species of MetaboliteComponentSourceComments
Inonotus obliquus (ncbitaxon:167356) - PubMed (17980585)
ChEBI Ontology
Outgoing Relation(s)
Inonoblin B (CHEBI:205190) is a isocoumarins (CHEBI:38758)
IUPAC Name 
3-(1-acetyl-1,5,6-trihydroxyinden-2-yl)-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione
Manual XrefsDatabases
23298717ChemSpider