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CHEBI:78288 - elloramycin A

Default Structure
ChEBI IDCHEBI:78288
ChEBI Nameelloramycin A
Stars
DefinitionA member of the class of tetracenomycins that is 8-demethyltetracenomycin C in which the hydroxyl hydrogens at position 8 and 10 a are replaced by a 2,3,4-tri-O-methyl-α-L-rhamnosyl and methyl groups respectively.
Secondary ChEBI IDCHEBI:31534
Last Modified15 December 2020
SubmitterKAX
DownloadsMolfile
FormulaC32H36O15
Net Charge0
Average Mass660.625
Monoisotopic Mass660.20542
SMILESCOC(=O)c1c(O[C@@H]2O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]2OC)cc2cc3c(c(O)c2c1C)C(=O)[C@]1(OC)C(=O)C=C(OC)[C@@H](O)[C@]1(O)C3=O
InChIInChI=1S/C32H36O15/c1-12-19-14(10-16(20(12)29(38)44-7)47-30-25(43-6)24(42-5)23(41-4)13(2)46-30)9-15-21(22(19)34)28(37)32(45-8)18(33)11-17(40-3)27(36)31(32,39)26(15)35/h9-11,13,23-25,27,30,34,36,39H,1-8H3/t13-,23-,24+,25+,27+,30-,31+,32+/m0/s1
InChIKeyOYEXGNNKRQPUBW-FJYHMNRNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces olivaceus (ncbitaxon:47716) - PubMed (11376004)
Roles Classification
Biological Roles:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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)
elloramycin A (CHEBI:78288) has functional parent tetracenomycin C (CHEBI:9470)
elloramycin A (CHEBI:78288) has role antimicrobial agent (CHEBI:33281)
elloramycin A (CHEBI:78288) has role bacterial metabolite (CHEBI:76969)
elloramycin A (CHEBI:78288) is a carboxylic ester (CHEBI:33308)
elloramycin A (CHEBI:78288) is a enol ether (CHEBI:47985)
elloramycin A (CHEBI:78288) is a enone (CHEBI:51689)
elloramycin A (CHEBI:78288) is a methyl ester (CHEBI:25248)
elloramycin A (CHEBI:78288) is a monosaccharide derivative (CHEBI:63367)
elloramycin A (CHEBI:78288) is a phenols (CHEBI:33853)
elloramycin A (CHEBI:78288) is a tertiary α-hydroxy ketone (CHEBI:139592)
elloramycin A (CHEBI:78288) is a tetracenomycin (CHEBI:48132)
elloramycin A (CHEBI:78288) is a α-L-rhamnoside (CHEBI:27848)
IUPAC Name 
methyl (6aR,7S,10aR)-3-[(6-deoxy-2,3,4-tri-O-methyl-α-L-mannopyranosyl)oxy]-6a,7,12-trihydroxy-8,10a-dimethoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate
Synonym  Source
ElloramycinKNApSAcK
UniProt Name  Source
elloramycin AUniProt
Manual XrefsDatabases
C00017718KNApSAcK
C12381KEGG COMPOUND
CPD-16637MetaCyc
Registry NumbersSources
CAS:97218-42-3ChemIDplus
CAS:97218-42-3KEGG COMPOUND
Citations