Amikacin sulfate salt

C₂₂H₄₅N₅O₁₇SCAS 149022-22-0683.68 g/mol

Open in Covalent MOL file

Acetal Alcohol Amide Ether Primary amine

Properties

Molecular formula: C₂₂H₄₅N₅O₁₇S
Molar mass: 683.68 g/mol
Exact mass: 683.2531 Da
logP: -9.08Crippen estimate
Polar surface area: 406.5 Å²
H-bond donors / acceptors: 15 / 19
Rotatable bonds: 10
Stereocentres: S, R, S, S, R, S, S, R, S, S, R, R, R, S, S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

149022-22-0

SMILES

C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1NC(=O)[C@H](CCN)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N.OS(=O)(=O)O

InChIKey

HIBICIOPDUTNRR-XTHCGPPUSA-N

InChI

InChI=1S/C22H43N5O13.H2O4S/c23-2-1-8(29)20(36)27-7-3-6(25)18(39-22-16(34)15(33)13(31)9(4-24)37-22)17(35)19(7)40-21-14(32)11(26)12(30)10(5-28)38-21;1-5(2,3)4/h6-19,21-22,28-35H,1-5,23-26H2,(H,27,36);(H2,1,2,3,4)/t6-,7+,8-,9+,10+,11-,12+,13+,14+,15-,16+,17-,18+,19-,21+,22+;/m0./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Amikacin sulfate salt

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Amikacin37517-28-5Free base Amikacin sulfate39831-55-5

Similar compounds

Kanamycin sulfate25389-94-069 % similar Tobramycin sulfate49842-07-160 % similar Tobramycin sulfate79645-27-560 % similar Kanamycin A59-01-857 % similar Ribostamycin sulfate53797-35-656 % similar Kanamycin B4696-76-854 % similar Paromomycin sulfate1263-89-453 % similar Neomycin sulfate1405-10-351 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook