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CHEBI:204476 - Daunomycinone

ChEBI IDCHEBI:204476
ChEBI NameDaunomycinone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H18O8
Net Charge0
Average Mass398.367
Monoisotopic Mass398.10017
SMILESCOc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O
InChIInChI=1S/C21H18O8/c1-8(22)21(28)6-10-13(11(23)7-21)19(26)16-15(18(10)25)17(24)9-4-3-5-12(29-2)14(9)20(16)27/h3-5,11,23,25-26,28H,6-7H2,1-2H3/t11-,21-/m0/s1
InChIKeyYOFDHOWPGULAQF-MQJDWESPSA-N
Species of MetaboliteComponentSourceComments
Streptomyces peucetius (ncbitaxon:1950) - DOI (10.1021/ja01077a059)
ChEBI Ontology
Outgoing Relation(s)
Daunomycinone (CHEBI:204476) is a quinone (CHEBI:36141)
Daunomycinone (CHEBI:204476) is a tetracenes (CHEBI:51270)
IUPAC Name 
(7S,9S)-9-acetyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Manual XrefsDatabases
75661ChemSpider