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CHEBI:32197 - tetracenomycin A2

ChEBI IDCHEBI:32197
ChEBI Nametetracenomycin A2
Stars
Last Modified14 April 2015
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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:
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.
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
Tetracenomycin A2KEGG COMPOUND
Tcm A2ChemIDplus
UniProt Name  Source
tetracenomycin A2UniProt
Manual XrefsDatabases
C12371KEGG COMPOUND
Registry NumbersSources
Beilstein:5460638Beilstein
CAS:82277-62-1ChemIDplus