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CHEBI:32197 - tetracenomycin A2

Default Structure
ChEBI IDCHEBI:32197
ChEBI Nametetracenomycin A2
Stars
Last Modified14 April 2015
DownloadsMolfile
FormulaC23H18O8
Net Charge0
Average Mass422.389
Monoisotopic Mass422.10017
SMILESCOC(=O)c1c(OC)cc2cc3c(c(O)c2c1C)C(=O)c1c(O)cc(OC)cc1C3=O
InChIInChI=1S/C23H18O8/c1-9-16-10(6-15(30-3)17(9)23(28)31-4)5-12-19(21(16)26)22(27)18-13(20(12)25)7-11(29-2)8-14(18)24/h5-8,24,26H,1-4H3
InChIKeyBXLGPMDGOMEFBX-UHFFFAOYSA-N
Roles Classification
Biological Roles:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tetracenomycin A2 (CHEBI:32197) is a methyl ester (CHEBI:25248)
tetracenomycin A2 (CHEBI:32197) is a tetracenequinones (CHEBI:51286)
tetracenomycin A2 (CHEBI:32197) is a tetracenomycin (CHEBI:48132)
IUPAC Name 
methyl 10,12-dihydroxy-3,8-dimethoxy-1-methyl-6,11-dioxo-6,11-dihydrotetracene-2-carboxylate
Synonyms  Source
Tcm A2ChemIDplus
Tetracenomycin A2KEGG COMPOUND
UniProt Name  Source
tetracenomycin A2UniProt
Manual XrefsDatabases
C12371KEGG COMPOUND
Registry NumbersSources
Beilstein:5460638Beilstein
CAS:82277-62-1ChemIDplus