CHEBI:72757 - 2'-oxokanamycin(4+)

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ChEBI Name 2'-oxokanamycin(4+) ChEBI ID CHEBI:72757 Definition A quadruply-charged organic cation arising from protonation of the four amino groups of 2'-oxokanamycin A; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H38N4O11 Net Charge +4 Average Mass 486.51450 Monoisotopic Mass 486.25151 InChI InChI=1S/C18H34N4O11/c19-2-6-10(25)12(27)13(28)18(30-6)33-16-5(21)1-4(20)15(14(16)29)32-17-11(26)8(22)9(24)7(3-23)31-17/h4-12,14-18,23-27,29H,1-3,19-22H2/p+4/t4-,5+,6-,7-,8+,9-,10-,11-,12+,14-,15+,16-,17-,18-/m1/s1 InChIKey FQALWUBUOWECTR-WSWRBCCJSA-R SMILES [NH3+]C[C@H]1O[C@H](O[C@@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H]([NH3+])[C@H]3O)[C@H]2O)C(=O)[C@@H](O)[C@@H]1O ChEBI Ontology Outgoing 2'-oxokanamycin(4+) (CHEBI:72757) is a ammonium ion derivative (CHEBI:35274) 2'-oxokanamycin(4+) (CHEBI:72757) is a organic cation (CHEBI:25697) 2'-oxokanamycin(4+) (CHEBI:72757) is conjugate acid of 2'-oxokanamycin (CHEBI:72769) Incoming 2'-oxokanamycin (CHEBI:72769) is conjugate base of 2'-oxokanamycin(4+) (CHEBI:72757) IUPAC Name (1S,2R,3R,4S,6R)-4,6-diazaniumyl-3-[(6-azaniumyl-6-deoxy-α-D-arabino-hexopyranosyl-2-ulose)oxy]-2-hydroxycyclohexyl 3-azaniumyl-3-deoxy-α-D-glucopyranoside Synonyms Sources 2'-dehydrokanamycin A UniProt 2'-dehydrokanamycin A(4+) ChEBI 2'-ketokanamycin(4+) ChEBI Citation Type Source 22374809 PubMed citation SUBMITTER Last Modified 24 July 2013