Kanamycin sulfateProduct ingredient for Kanamycin

Name
Kanamycin sulfate
Drug Entry
Kanamycin

Kanamycin (also known as kanamycin A) is an aminoglycoside bacteriocidal antibiotic, available in oral, intravenous, and intramuscular forms, and used to treat a wide variety of infections. Kanamycin is isolated from the bacterium Streptomyces kanamyceticus and its most commonly used form is kanamycin sulfate.

Accession Number
DBSALT000401
Structure
Synonyms
Kanamycin A sulfate / Kanamycin A sulphate / Kanamycin acid sulfate / Kanamycin monosulfate / Kanamycin sulphate
UNII
J80EX28SMQ
CAS Number
25389-94-0
Weight
Average: 582.577
Monoisotopic: 582.205437256
Chemical Formula
C18H38N4O15S
InChI Key
OOYGSFOGFJDDHP-KMCOLRRFSA-N
InChI
InChI=1S/C18H36N4O11.H2O4S/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;1-5(2,3)4/h4-18,23-29H,1-3,19-22H2;(H2,1,2,3,4)/t4-,5+,6-,7-,8+,9-,10-,11-,12+,13-,14-,15+,16-,17-,18-;/m1./s1
IUPAC Name
(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-{[(1R,2R,3S,4R,6S)-4,6-diamino-3-{[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-hydroxycyclohexyl]oxy}oxane-3,4,5-triol; sulfuric acid
SMILES
OS(O)(=O)=O.[H][C@@]1(N)C[C@]([H])(N)[C@@]([H])(O[C@@]2([H])O[C@]([H])(CN)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@@]1([H])O[C@@]1([H])O[C@]([H])(CO)[C@@]([H])(O)[C@]([H])(N)[C@@]1([H])O
KEGG Compound
C08046
PubChem Compound
441374
ChemSpider
390116
ChEBI
6109
ChEMBL
CHEMBL1446
Wikipedia
Kanamycin_A
Predicted Properties
PropertyValueSource
Water Solubility92.3 mg/mLALOGPS
logP-3.1ALOGPS
logP-7.1Chemaxon
logS-0.72ALOGPS
pKa (Strongest Acidic)12.11Chemaxon
pKa (Strongest Basic)9.54Chemaxon
Physiological Charge4Chemaxon
Hydrogen Acceptor Count15Chemaxon
Hydrogen Donor Count11Chemaxon
Polar Surface Area282.61 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity106.13 m3·mol-1Chemaxon
Polarizability47.29 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon