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CHEBI:226327 - Naphthacemycin B5

ChEBI IDCHEBI:226327
ChEBI NameNaphthacemycin B5
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H23ClO7
Net Charge0
Average Mass506.938
Monoisotopic Mass506.11323
SMILESCOc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C
InChIInChI=1S/C28H23ClO7/c1-11-21(20(36-4)10-19(33)25(11)29)15-7-13(30)5-12-6-16-24(26(34)22(12)15)27(35)23-17(28(16,2)3)8-14(31)9-18(23)32/h5-10,30-34H,1-4H3
InChIKeyGNAKKJPJIZPORK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32298122)
ChEBI Ontology
Outgoing Relation(s)
Naphthacemycin B5 (CHEBI:226327) is a tetracenes (CHEBI:51270)
IUPAC Name 
7-(3-chloro-4-hydroxy-6-methoxy-2-methylphenyl)-2,4,6,9-tetrahydroxy-12,12-dimethyltetracen-5-one
Manual XrefsDatabases
127422857ChemSpider