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CHEBI:65474 - BE-24566B

Default Structure
ChEBI IDCHEBI:65474
ChEBI NameBE-24566B
Stars
DefinitionAn organic heterohexacyclic compound that is 6,7,9,16-tetrahydro-14H-6,16-epoxyanthra[2,3-e]benzo[b]oxocin-14-one substituted by hydroxy groups at positions 3, 11, 13 and 15, methyl groups at positions 1 and 4 and geminal methyl groups at position 9 respectively. It is isolated from the fermentation broth of Streptomyces violaceusniger and exhibits moderate antibacterial activity.
Last Modified20 November 2012
DownloadsMolfile
FormulaC27H24O7
Net Charge0
Average Mass460.482
Monoisotopic Mass460.15220
SMILESCc1cc(O)cc2c1C1OC(C)(Cc3cc4c(c(O)c31)C(=O)c1c(O)cc(O)cc1C4(C)C)O2
InChIInChI=1S/C27H24O7/c1-11-5-13(28)9-18-19(11)25-20-12(10-27(4,33-18)34-25)6-15-22(23(20)31)24(32)21-16(26(15,2)3)7-14(29)8-17(21)30/h5-9,25,28-31H,10H2,1-4H3
InChIKeyMDUGEFRGUDVHQH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces violaceusniger (ncbitaxon:68280) - PubMed (8557611)
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
ChEBI Ontology
Outgoing Relation(s)
BE-24566B (CHEBI:65474) has role antibacterial agent (CHEBI:33282)
BE-24566B (CHEBI:65474) has role antimicrobial agent (CHEBI:33281)
BE-24566B (CHEBI:65474) has role metabolite (CHEBI:25212)
BE-24566B (CHEBI:65474) is a bridged compound (CHEBI:35990)
BE-24566B (CHEBI:65474) is a cyclic ketone (CHEBI:3992)
BE-24566B (CHEBI:65474) is a organic heterohexacyclic compound (CHEBI:51914)
BE-24566B (CHEBI:65474) is a oxacycle (CHEBI:38104)
BE-24566B (CHEBI:65474) is a polyphenol (CHEBI:26195)
IUPAC Name 
3,11,13,15-tetrahydroxy-1,6,9,9-tetramethyl-6,7,9,16-tetrahydro-14H-6,16-epoxyanthra[2,3-e]benzo[b]oxocin-14-one
Registry NumbersSources
Reaxys:15840383Reaxys
Citations