CHEBI:57909 - kanamycin A 3'-phosphate(2+)

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ChEBI Name kanamycin A 3'-phosphate(2+)
ChEBI ID CHEBI:57909
Definition The doubly positive charged ammonium ion obtained from protonation of the four amino groups and deprotonation of the phosphate OH groups of kanamycin A 3'-phosphate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H39N4O14P
Net Charge +2
Average Mass 566.49440
Monoisotopic Mass 566.21894
InChI InChI=1S/C18H37N4O14P/c19-2-6-10(25)16(36-37(29,30)31)13(28)18(32-6)35-15-5(21)1-4(20)14(12(15)27)34-17-11(26)8(22)9(24)7(3-23)33-17/h4-18,23-28H,1-3,19-22H2,(H2,29,30,31)/p+2/t4-,5+,6-,7-,8+,9-,10-,11-,12-,13-,14+,15-,16+,17-,18-/m1/s1
InChIKey BYGWYFIZOSNIDM-CAFUKSGOSA-P
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@H](O)[C@@H](OP([O-])([O-])=O)[C@@H]1O
ChEBI Ontology
Outgoing kanamycin A 3'-phosphate(2+) (CHEBI:57909) is a ammonium ion derivative (CHEBI:35274)
kanamycin A 3'-phosphate(2+) (CHEBI:57909) is conjugate acid of kanamycin A 3'-phosphate (CHEBI:16823)
Incoming kanamycin A 3'-phosphate (CHEBI:16823) is conjugate base of kanamycin A 3'-phosphate(2+) (CHEBI:57909)
IUPAC Name
(1S,2R,3R,4S,6R)-4,6-diazaniumyl-3-(6-azaniumyl-6-deoxy-3-O-phosphono-α-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-azaniumyl-3-deoxy-α-D-glucopyranoside
Synonyms Sources
kanamycin 3'-phosphate UniProt
kanamycin A 3'-phosphate dication ChEBI
Last Modified
13 November 2017