CHEBI:72944 - 3''-deamino-3''-hydroxykanamycin B(4+)

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ChEBI Name 3''-deamino-3''-hydroxykanamycin B(4+) ChEBI ID CHEBI:72944 Definition An organic cation obtained by protonation of the primary amino groups of 3''-deamino-3''-hydroxykanamycin B. 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 C18H40N4O11 Net Charge +4 Average Mass 488.53040 Monoisotopic Mass 488.26716 InChI InChI=1S/C18H36N4O11/c19-2-6-9(24)11(26)8(22)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)12(27)10(25)7(3-23)31-18/h4-18,23-29H,1-3,19-22H2/p+4/t4-,5+,6+,7+,8+,9+,10+,11+,12-,13+,14-,15+,16-,17+,18+/m0/s1 InChIKey MOWMHIINUAQFMU-DNBVWFFRSA-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](O)[C@H]3O)[C@H]2O)[C@H]([NH3+])[C@@H](O)[C@@H]1O ChEBI Ontology Outgoing 3''-deamino-3''-hydroxykanamycin B(4+) (CHEBI:72944) is a ammonium ion derivative (CHEBI:35274) 3''-deamino-3''-hydroxykanamycin B(4+) (CHEBI:72944) is a organic cation (CHEBI:25697) 3''-deamino-3''-hydroxykanamycin B(4+) (CHEBI:72944) is conjugate acid of 3''-deamino-3''-hydroxykanamycin B (CHEBI:72990) Incoming 3''-deamino-3''-hydroxykanamycin B (CHEBI:72990) is conjugate base of 3''-deamino-3''-hydroxykanamycin B(4+) (CHEBI:72944) IUPAC Name (1S,2S,3R,4S,6R)-4,6-diazaniumyl-3-[(2,6-diazaniumyl-2,6-dideoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl α-D-glucopyranoside Synonym Source 3''-deamino-3''-hydroxykanamycin B UniProt Manual Xref Database CPD-14139 MetaCyc View more database links Citation Type Source 22374809 PubMed citation SUBMITTER Last Modified 13 June 2022