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CHEBI:218877 - Cladosporol J

ChEBI IDCHEBI:218877
ChEBI NameCladosporol J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O5
Net Charge0
Average Mass338.359
Monoisotopic Mass338.11542
SMILESO=C1CC[C@@H](c2ccc(O)c3c2C(=O)CC[C@H]3O)c2cccc(O)c21
InChIInChI=1S/C20H18O5/c21-13-3-1-2-11-10(4-6-14(22)18(11)13)12-5-7-16(24)20-17(25)9-8-15(23)19(12)20/h1-3,5,7,10,17,21,24-25H,4,6,8-9H2/t10-,17-/m1/s1
InChIKeyBXGHBKTYAIAELJ-BMLIUANNSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - PubMed (28853887)
ChEBI Ontology
Outgoing Relation(s)
Cladosporol J (CHEBI:218877) is a tetralins (CHEBI:36786)
IUPAC Name 
(4R)-4,5-dihydroxy-8-[(1S)-5-hydroxy-4-oxo-2,3-dihydro-1H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-one
Manual XrefsDatabases
62285700ChemSpider