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CHEBI:207080 - Rubiginone B2

ChEBI IDCHEBI:207080
ChEBI NameRubiginone B2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H16O4
Net Charge0
Average Mass320.344
Monoisotopic Mass320.10486
SMILESCOc1cccc2c1C(=O)c1ccc3c(c1C2=O)C(=O)C[C@@H](C)C3
InChIInChI=1S/C20H16O4/c1-10-8-11-6-7-13-18(16(11)14(21)9-10)20(23)12-4-3-5-15(24-2)17(12)19(13)22/h3-7,10H,8-9H2,1-2H3/t10-/m0/s1
InChIKeyZUCWNLVDTXGGSU-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseorubiginosus (ncbitaxon:67304) - PubMed (2211364)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Rubiginone B2 (CHEBI:207080) is a angucycline (CHEBI:48130)
IUPAC Name 
(3S)-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
Manual XrefsDatabases
9133395ChemSpider