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 No supplier information found for this compound.
Download Molfile XML SDF
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