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CHEBI:223221 - Auramycin C

ChEBI IDCHEBI:223221
ChEBI NameAuramycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H43NO13
Net Charge0
Average Mass685.723
Monoisotopic Mass685.27344
SMILESCOC(=O)[C@@H]1c2cc3c(c(O)c2[C@@H](O[C@@H]2C[C@H](N(C)C)[C@@H](O[C@H]4C[C@H](O)[C@H](O)[C@H](C)O4)[C@H](C)O2)C[C@@]1(C)O)C(=O)c1c(O)cccc1C3=O
InChIInChI=1S/C35H43NO13/c1-14-29(39)21(38)12-24(46-14)49-33-15(2)47-23(11-19(33)36(4)5)48-22-13-35(3,44)28(34(43)45-6)17-10-18-27(32(42)26(17)22)31(41)25-16(30(18)40)8-7-9-20(25)37/h7-10,14-15,19,21-24,28-29,33,37-39,42,44H,11-13H2,1-6H3/t14-,15-,19-,21-,22-,23+,24-,28-,29+,33-,35+/m0/s1
InChIKeyUMJYAGXWXMMVDD-LBHTYKJQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7186414)
Roles Classification
Biological Role:
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)
Auramycin C (CHEBI:223221) is a anthracycline (CHEBI:48120)
IUPAC Name 
methyl (1R,2R,4S)-4-[(2S,4S,5R,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2,5,7-trihydroxy-2-methyl-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
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78443072ChemSpider