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CHEBI:233248 - 4'-(2'-deoxyguanylyl)kanamycin A(3+)

ChEBI IDCHEBI:233248
ChEBI Name4'-(2'-deoxyguanylyl)kanamycin A(3+)
Stars
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC28H51N9O17P
Net Charge+3
Average Mass816.736
Monoisotopic Mass816.31241
SMILESNc1nc(=O)c2ncn([C@H]3C[C@H](O)[C@@H](COP(=O)([O-])O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H]([NH3+])[C@H]6O)[C@H]([NH3+])C[C@@H]5[NH3+])O[C@@H]4C[NH3+])O3)c2n1
InChIInChI=1S/C28H48N9O17P/c29-3-10-23(54-55(46,47)48-5-12-9(39)2-13(49-12)37-6-34-15-24(37)35-28(33)36-25(15)45)18(42)19(43)27(50-10)53-22-8(31)1-7(30)21(20(22)44)52-26-17(41)14(32)16(40)11(4-38)51-26/h6-14,16-23,26-27,38-44H,1-5,29-32H2,(H,46,47)(H3,33,35,36,45)/p+3/t7-,8+,9+,10-,11-,12-,13-,14+,16-,17-,18-,19-,20-,21+,22-,23-,26-,27-/m1/s1
InChIKeyWENNPZFRHIGQCJ-KRDQRBGESA-Q
ChEBI Ontology
Outgoing Relation(s)
4'-(2'-deoxyguanylyl)kanamycin A(3+) (CHEBI:233248) has functional parent kanamycin A(4+) (CHEBI:58214)
4'-(2'-deoxyguanylyl)kanamycin A(3+) (CHEBI:233248) is a ammonium ion derivative (CHEBI:35274)
Synonym  Source
4'-dGMP-kanamycin ASUBMITTER
UniProt Name  Source
4'-(2'-deoxyguanylyl)kanamycin AUniProt
Citations