(2R,3S,4R,5R,6R)-2-(aminomethyl)-5-azanyl-6-[(1R,2R,3S,4R,6S)-4,6-bis(azanyl)-3-oxidanyl-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]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-oxidanyl-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]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-hydroxy-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]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-hydroxy-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]cyclohexyl]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-hydroxy-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]cyclohexyl]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-hydroxy-2-[2-(5,6,7,8-tetrahydroquinolin-6-ylamino)ethoxy]cyclohexoxy]tetrahydropyran-3,4-diol Formula: C23H40N6O6 MolecularWeight: 496.6003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1NCCOC3C(C(CC(C3OC4C(C(C(C(O4)CN)O)O)N)N)N)O)C=CC=N2

Isomeric SMILES

C1CC2=C(CC1NCCO[C@@H]3[C@H]([C@@H](C[C@@H]([C@H]3O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CN)O)O)N)N)N)O)C=CC=N2

InChI

InChI=1S/C23H40N6O6/c24-10-16-19(31)20(32)17(27)23(34-16)35-21-14(26)9-13(25)18(30)22(21)33-7-6-28-12-3-4-15-11(8-12)2-1-5-29-15/h1-2,5,12-14,16-23,28,30-32H,3-4,6-10,24-27H2/t12?,13-,14+,16-,17-,18+,19-,20-,21-,22-,23-/m1/s1