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CHEBI:233247 - 4'-(2'-deoxycytidylyl)kanamycin A(3+)

ChEBI IDCHEBI:233247
ChEBI Name4'-(2'-deoxycytidylyl)kanamycin A(3+)
Stars
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC27H51N7O17P
Net Charge+3
Average Mass776.711
Monoisotopic Mass776.30626
SMILESNc1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H]([NH3+])[C@H]5O)[C@H]([NH3+])C[C@@H]4[NH3+])O[C@@H]3C[NH3+])O2)c(=O)n1
InChIInChI=1S/C27H48N7O17P/c28-5-11-24(51-52(43,44)45-7-13-10(36)4-15(46-13)34-2-1-14(31)33-27(34)42)19(39)20(40)26(47-11)50-23-9(30)3-8(29)22(21(23)41)49-25-18(38)16(32)17(37)12(6-35)48-25/h1-2,8-13,15-26,35-41H,3-7,28-30,32H2,(H,43,44)(H2,31,33,42)/p+3/t8-,9+,10+,11-,12-,13-,15-,16+,17-,18-,19-,20-,21-,22+,23-,24-,25-,26-/m1/s1
InChIKeySRQASKPKPXMGCS-NJJBPVAMSA-Q
ChEBI Ontology
Outgoing Relation(s)
4'-(2'-deoxycytidylyl)kanamycin A(3+) (CHEBI:233247) has functional parent kanamycin A(4+) (CHEBI:58214)
4'-(2'-deoxycytidylyl)kanamycin A(3+) (CHEBI:233247) is a ammonium ion derivative (CHEBI:35274)
Synonym  Source
4'-dCMP-kanamycin ASUBMITTER
UniProt Name  Source
4'-(2'-deoxycytidylyl)kanamycin AUniProt
Citations