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CHEBI:213243 - Nodulisporin C

ChEBI IDCHEBI:213243
ChEBI NameNodulisporin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H14O6
Net Charge0
Average Mass350.326
Monoisotopic Mass350.07904
SMILESO=C(O)c1ccc(-c2ccc(C(=O)O)c3c2CCC3=O)c2c1C(=O)CC2
InChIInChI=1S/C20H14O6/c21-15-7-5-11-9(1-3-13(17(11)15)19(23)24)10-2-4-14(20(25)26)18-12(10)6-8-16(18)22/h1-4H,5-8H2,(H,23,24)(H,25,26)
InChIKeyKTRGNOBQQZGOGZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies (ncbitaxon:1897413) - DOI (10.1002/ejoc.200600261)
ChEBI Ontology
Outgoing Relation(s)
Nodulisporin C (CHEBI:213243) is a indanones (CHEBI:24789)
IUPAC Name 
7-(7-carboxy-1-oxo-2,3-dihydroinden-4-yl)-3-oxo-1,2-dihydroindene-4-carboxylic acid
Manual XrefsDatabases
17239297ChemSpider