Isepamicin Sulfate

(2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxypropanamide;sulfuric acid

Also Known As: isepamicin sulfate|Isepamicin sulphate|Isepacin|Ispallin|Exacin|Isepalline|Isepamicin|Isepamicina|Isepamicine|Isepamicinum|Isepamicin monosulfate|Isepamicine sulphate|HAPA-B sulfate|HAPA-gentamycin B|Isepamicin sulfate [MI]|Isepamicin sulfate [JAN]|Isepamicin (sulfate)|Isepamicine [French]|Isepamicinum [Latin]|Isepamicina [Spanish]|Isepamicine (Isepamycin|HAPA-B|Sch 21420 sulfate|sch21420) Sulphate|Isepamicin sulfate [WHO-DD]|Sch 21420 (sulfate)|Isepamicin sulfate - 70%|Isepamicin [USAN:BAN:INN]|Isepamicin [USAN:INN:BAN]|Sch 21420|EINECS 261-143-4|s4271

Molecular Formula	C22H45N5O16S
Molecular Weight	667.2582 g/mol
LogP	-8.1772
Topological Polar Surface Area	381.0 Ų
Hydrogen Bond Donors	14
Hydrogen Bond Acceptors	20
Rotatable Bonds	9
Exact Mass	667.2582
Monoisotopic Mass	667.2582
Heavy Atoms	44
Complexity	899.0

Chemical Identifiers

CAS Number	393574-17-9
SMILES	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O.OS(=O)(=O)O
InChIKey	DDXRHRXGIWOVDQ-MGAUJLSLSA-N