AC1MHEKH

4-amino-2-[4,6-diamino-3-[3-amino-5-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol

Also Known As: 3',4'-Dideoxykanamycin C hemihydrate|C18H36N4O9.1/2H2O|C18-H36-N4-O9.1/2H2-O|4-amino-2-[4,6-diamino-3-[3-amino-5-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxy-cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol|D-Streptamine, O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1-6)-O-(2-amino-2,3,4-trideoxy-alpha-D-erythro-hexopyranosyl-(1-4))-2-deoxy-, hydrate (2:1)|4-amino-2-[4,6-diamino-3-[3-amino-5-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol|4,6-Diamino-3-{[3-amino-5-(hydroxymethyl)oxan-2-yl]oxy}-2-hydroxycyclohexyl 3-amino-3-deoxyhexopyranoside

Molecular Formula	C18H36N4O9
Molecular Weight	452.24823 g/mol
LogP	-5.3755
Topological Polar Surface Area	242.15 Ų
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	13
Rotatable Bonds	6
Exact Mass	452.24823
Monoisotopic Mass	452.24823
Heavy Atoms	31
Complexity	576.1485

Chemical Identifiers

CAS Number	65566-76-9
SMILES	C1C(COC(C1N)OC2C(CC(C(C2O)OC3C(C(C(C(O3)CO)O)N)O)N)N)CO