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CHEBI:199764 - Cytosaminomycin A

ChEBI IDCHEBI:199764
ChEBI NameCytosaminomycin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34N4O8S
Net Charge0
Average Mass514.601
Monoisotopic Mass514.20974
SMILESCS/C=C/C(=O)Nc1ccn([C@H]2C[C@@H](O)[C@H](O[C@H]3O[C@H](C)[C@@H](N(C)C)[C@H](O)[C@H]3O)[C@@H](C)O2)c(=O)n1
InChIInChI=1S/C22H34N4O8S/c1-11-17(25(3)4)18(29)19(30)21(33-11)34-20-12(2)32-16(10-13(20)27)26-8-6-14(24-22(26)31)23-15(28)7-9-35-5/h6-9,11-13,16-21,27,29-30H,10H2,1-5H3,(H,23,24,28,31)/b9-7+/t11-,12-,13-,16-,17-,18+,19-,20-,21-/m1/s1
InChIKeyOEIFFRHFKRNPAL-ZQEFWBPISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (8071122)
ChEBI Ontology
Outgoing Relation(s)
Cytosaminomycin A (CHEBI:199764) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(E)-N-[1-[(2R,4R,5S,6R)-5-[(2R,3R,4S,5S,6R)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-yl]-3-methylsulanylprop-2-enamide
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8499637ChemSpider