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CHEBI:198314 - Cladosporol E

ChEBI IDCHEBI:198314
ChEBI NameCladosporol E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O7
Net Charge0
Average Mass370.357
Monoisotopic Mass370.10525
SMILESO=C1CC[C@H](c2ccc(O)c3c2C(=O)[C@@H](O)[C@H](O)[C@@H]3O)c2cccc(O)c21
InChIInChI=1S/C20H18O7/c21-11-3-1-2-9-8(4-6-12(22)14(9)11)10-5-7-13(23)16-15(10)17(24)19(26)20(27)18(16)25/h1-3,5,7-8,18-21,23,25-27H,4,6H2/t8-,18+,19+,20+/m0/s1
InChIKeyJBFOPERWPRSEMH-UAUONSKVSA-N
Species of MetaboliteComponentSourceComments
Cladosporium tenuissimum (ncbitaxon:70808) - PubMed (15279980)
ChEBI Ontology
Outgoing Relation(s)
Cladosporol E (CHEBI:198314) is a tetralins (CHEBI:36786)
IUPAC Name 
(2S,3R,4R)-2,3,4,5-tetrahydroxy-8-[(1R)-5-hydroxy-4-oxo-2,3-dihydro-1H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-one
Manual XrefsDatabases
9351251ChemSpider