2-[2-[3-[3-azanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-4,5-bis(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]oxy-5-[bis(azanyl)methylideneamino]-3,4,6-tris(oxidanyl)cyclohexyl]guanidine trihydrochloride

Systemtic Name: 2-[2-[3-[3-azanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-4,5-bis(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]oxy-5-[bis(azanyl)methylideneamino]-3,4,6-tris(oxidanyl)cyclohexyl]guanidine trihydrochloride Openeye Name: 2-[2-[3-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-hydroxy-4,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-5-guanidino-3,4,6-trihydroxy-cyclohexyl]guanidine trihydrochloride CAS Name: 2-[2-[[3-[[3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4-hydroxy-4,5-bis(hydroxymethyl)-2-oxolanyl]oxy]-5-(diaminomethylideneamino)-3,4,6-trihydroxycyclohexyl]guanidine trihydrochloride IUPAC Name: 2-[2-[3-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-4,5-bis(hydroxymethyl)oxolan-2-yl]oxy-5-(diaminomethylideneamino)-3,4,6-trihydroxycyclohexyl]guanidine trihydrochloride Traditional Name: 2-[2-[3-(3-amino-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-4-hydroxy-4,5-dimethylol-tetrahydrofuran-2-yl]oxy-5-guanidino-3,4,6-trihydroxy-cyclohexyl]guanidine trihydrochloride Formula: C20H42Cl3N7O13 MolecularWeight: 694.94558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(C(O1)OC2C(OC(C2(CO)O)CO)OC3C(C(C(C(C3O)O)N=C(N)N)O)N=C(N)N)N)O)O)O.Cl.Cl.Cl

Isomeric SMILES

C(C1C(C(C(C(O1)OC2C(OC(C2(CO)O)CO)OC3C(C(C(C(C3O)O)N=C(N)N)O)N=C(N)N)N)O)O)O.Cl.Cl.Cl

InChI

InChI=1S/C20H39N7O13.3ClH/c21-6-10(32)9(31)4(1-28)37-16(6)40-15-17(38-5(2-29)20(15,36)3-30)39-14-8(27-19(24)25)11(33)7(26-18(22)23)12(34)13(14)35;;;/h4-17,28-36H,1-3,21H2,(H4,22,23,26)(H4,24,25,27);3*1H