(2R,3S,4R,5R,6R)-2-(aminomethyl)-5-azanyl-6-[(1R,2R,3S,4R,6S)-4,6-bis(azanyl)-3-[2-(4-azanylbutylamino)ethoxy]-2-oxidanyl-cyclohexyl]oxy-oxane-3,4-diol

Systemtic Name: (2R,3S,4R,5R,6R)-2-(aminomethyl)-5-azanyl-6-[(1R,2R,3S,4R,6S)-4,6-bis(azanyl)-3-[2-(4-azanylbutylamino)ethoxy]-2-oxidanyl-cyclohexyl]oxy-oxane-3,4-diol Openeye Name: (2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[2-(4-aminobutylamino)ethoxy]-2-hydroxy-cyclohexoxy]tetrahydropyran-3,4-diol CAS Name: (2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[2-(4-aminobutylamino)ethoxy]-2-hydroxycyclohexyl]oxyoxane-3,4-diol IUPAC Name: (2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[2-(4-aminobutylamino)ethoxy]-2-hydroxycyclohexyl]oxyoxane-3,4-diol Traditional Name: (2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[2-(4-aminobutylamino)ethoxy]-2-hydroxy-cyclohexoxy]tetrahydropyran-3,4-diol Formula: C18H40N6O6 MolecularWeight: 436.5468

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1N)OC2C(C(C(C(O2)CN)O)O)N)O)OCCNCCCCN)N

Isomeric SMILES

C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O)OCCNCCCCN)N

InChI

InChI=1S/C18H40N6O6/c19-3-1-2-4-24-5-6-28-16-9(21)7-10(22)17(15(16)27)30-18-12(23)14(26)13(25)11(8-20)29-18/h9-18,24-27H,1-8,19-23H2/t9-,10+,11-,12-,13-,14-,15-,16+,17-,18-/m1/s1