(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; (2R)-4-azanyl-2-oxidanyl-butanal

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; (2R)-4-azanyl-2-oxidanyl-butanal 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; (2R)-4-amino-2-hydroxy-butanal 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; (2R)-4-amino-2-hydroxybutanal 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; (2R)-4-amino-2-hydroxybutanal 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; (2R)-4-amino-2-hydroxy-butyraldehyde Formula: C22H49N7O8 MolecularWeight: 539.66656

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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.C(CN)C(C=O)O

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.C(CN)[C@H](C=O)O

InChI

InChI=1S/C18H40N6O6.C4H9NO2/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;5-2-1-4(7)3-6/h9-18,24-27H,1-8,19-23H2;3-4,7H,1-2,5H2/t9-,10+,11-,12-,13-,14-,15-,16+,17-,18-;4-/m11/s1