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CHEBI:199493 - Palmarumycin CP2

ChEBI IDCHEBI:199493
ChEBI NamePalmarumycin CP2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H14O4
Net Charge0
Average Mass318.328
Monoisotopic Mass318.08921
SMILESO=C1CCC2(Oc3cccc4cccc(c34)O2)c2cccc(O)c21
InChIInChI=1S/C20H14O4/c21-14-7-3-6-13-19(14)15(22)10-11-20(13)23-16-8-1-4-12-5-2-9-17(24-20)18(12)16/h1-9,21H,10-11H2
InChIKeyBGMMZNMDIABGHL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Coniothyrium palmarum (ncbitaxon:300248) - PubMed (25855820)
ChEBI Ontology
Outgoing Relation(s)
Palmarumycin CP2 (CHEBI:199493) is a tetralins (CHEBI:36786)
IUPAC Name 
8-hydroxyspiro[2,3-dihydronaphthalene-4,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-1-one
Manual XrefsDatabases
8171573ChemSpider