CHEBI:31255 - bekanamycin sulfate

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ChEBI Name bekanamycin sulfate
ChEBI ID CHEBI:31255
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H37N5O10.H2O4S
Net Charge 0
Average Mass 581.59356
Monoisotopic Mass 581.22142
InChI InChI=1S/C18H37N5O10.H2O4S/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18;1-5(2,3)4/h4-18,24-29H,1-3,19-23H2;(H2,1,2,3,4)/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+;/m0./s1
InChIKey YGTPKDKJVZOVCO-KELBJJLKSA-N
SMILES OS(O)(=O)=O.NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing bekanamycin sulfate (CHEBI:31255) has functional parent kanamycin B (CHEBI:28098)
bekanamycin sulfate (CHEBI:31255) is a aminoglycoside sulfate salt (CHEBI:38012)
IUPAC Name
(1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-α-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-α-D-glucopyranoside sulfate
Synonyms Sources
AKM KEGG DRUG
Bekanamycin sulfate KEGG DRUG
Kanamycin B sulfate ChemIDplus
Brand Name Source
Kanendomycin KEGG DRUG
Manual Xref Database
D01868 KEGG DRUG
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Registry Numbers Types Sources
29701-07-3 CAS Registry Number ChemIDplus
5235274 Beilstein Registry Number Beilstein
Last Modified
15 June 2022