CHEBI:32049 - premithramycin A3'

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ChEBI Name premithramycin A3'
ChEBI ID CHEBI:32049
Definition A tetracenomycin that is an intermediate in the biosynthesis of the antitumour drug mithramycin by Streptomyces argillaceus.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H50O18
Net Charge 0
Average Mass 818.81420
Monoisotopic Mass 818.29971
InChI InChI=1S/C40H50O18/c1-14(41)28-34(47)35(52-6)21-9-19-7-18-8-20(42)10-22(43)29(18)33(46)30(19)38(50)40(21,37(28)49)58-26-12-24(32(45)16(3)54-26)56-25-11-23(31(44)15(2)53-25)57-27-13-39(5,51)36(48)17(4)55-27/h7-8,10,15-17,21,23-27,31-32,35-36,42-48,51H,9,11-13H2,1-6H3/t15-,16-,17-,21+,23-,24-,25+,26+,27+,31+,32-,35+,36-,39+,40-/m1/s1
InChIKey HEXWXHDQRMEJNB-QGYAIUEGSA-N
SMILES CO[C@H]1[C@@H]2Cc3cc4cc(O)cc(O)c4c(O)c3C(=O)[C@]2(O[C@H]2C[C@@H](O[C@H]3C[C@@H](O[C@H]4C[C@](C)(O)[C@H](O)[C@@H](C)O4)[C@@H](O)[C@@H](C)O3)[C@H](O)[C@@H](C)O2)C(=O)C(C(C)=O)=C1O
Metabolite of Species Details
Streptomyces argillaceus (NCBI:txid41951) of strain ATCC 12596 See: PubMed
Roles Classification
Biological Role(s): 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.
(via tetracenomycin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via tetracenomycin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing premithramycin A3' (CHEBI:32049) has role bacterial metabolite (CHEBI:76969)
premithramycin A3' (CHEBI:32049) is a aromatic ketone (CHEBI:76224)
premithramycin A3' (CHEBI:32049) is a cyclic ketone (CHEBI:3992)
premithramycin A3' (CHEBI:32049) is a enol (CHEBI:33823)
premithramycin A3' (CHEBI:32049) is a enone (CHEBI:51689)
premithramycin A3' (CHEBI:32049) is a ether (CHEBI:25698)
premithramycin A3' (CHEBI:32049) is a polyphenol (CHEBI:26195)
premithramycin A3' (CHEBI:32049) is a tetracenomycin (CHEBI:48132)
premithramycin A3' (CHEBI:32049) is a trisaccharide derivative (CHEBI:63571)
IUPAC Name
(1S,4aS,12aS)-3-acetyl-2,6,7,9-tetrahydroxy-1-methoxy-4,5-dioxo-1,5,12,12a-tetrahydrotetracen-4a(4H)-yl 2,6-dideoxy-3-C-methyl-β-D-ribo-hexopyranosyl-(1→3)-2,6-dideoxy-β-D-lyxo-hexopyranosyl-(1→3)-2,6-dideoxy-β-D-arabino-hexopyranoside
Synonyms Sources
9-demethylpremithramycin A3 MetaCyc
demethylpremithramycin A3 MetaCyc
Manual Xrefs Databases
C12386 KEGG COMPOUND
CPD-14348 MetaCyc
View more database links
Citation Waiting for Citations Type Source
10652287 PubMed citation Europe PMC
Last Modified
16 June 2015