Compound 2

Bis(1-(4-(4-((3-((4-((3-aminopropyl)amino)butyl)amino)propyl)amino)-4-oxobutoxy)-5-methoxy-2-nitrophenyl)ethyl)-3,3'-((2-((3-(1-(4-(4-((3-((4-((3-aminopropyl)amino)butyl)amino)propyl)amino)-4-oxobutoxy)-5-methoxy-2-nitrophenyl)ethoxy)-3-oxopropoxy)methyl)-2-(((benzyloxy)carbonyl)amino)propane-1,3-diyl)bis(oxy))dipropanoate

From: Self-assembly and optically triggered disassembly of hierarchical dendron–virus complexes

View in PubChem

Chemical formula: C90H155Cl9N16O26

Molecular weight: 2196.36

Elemental analysis: C, 49.22; H, 7.11; Cl, 14.53; N, 10.20; O, 18.94

Standard InChI=1S/C90H146N16O26.9ClH/c1-67(71-57-77(120-4)80(60-74(71)104(114)115)126-51-16-27-83(107)100-48-22-45-97-39-13-10-36-94-42-19-33-91)130-86(110)30-54-123-64-90(103-89(113)129-63-70-25-8-7-9-26-70,65-124-55-31-87(111)131-68(2)72-58-78(121-5)81(61-75(72)105(116)117)127-52-17-28-84(108)101-49-23-46-98-40-14-11-37-95-43-20-34-92)66-125-56-32-88(112)132-69(3)73-59-79(122-6)82(62-76(73)106(118)119)128-53-18-29-85(109)102-50-24-47-99-41-15-12-38-96-44-21-35-93;;;;;;;;;/h7-9,25-26,57-62,67-69,94-99H,10-24,27-56,63-66,91-93H2,1-6H3,(H,100,107)(H,101,108)(H,102,109)(H,103,113);9*1H

Standard InChIKey: MLLVJAPYVFYQMW-UHFFFAOYSA-N

SMILES: [NH3+]CCC[NH2+]CCCC[NH2+]CCCNC(CCCOC1=CC([N+]([O-])=O)=C(C(C)OC(CCOCC(COCCC(OC(C)C2=C([N+]([O-])=O)C=C(OCCCC(NCCC[NH2+]CCCC[NH2+]CCC[NH3+])=O)C(OC)=C2)=O)(COCCC(OC(C)C3=C([N+]([O-])=O)C=C(OCCCC(NCCC[NH2+]CCCC[NH2+]CCC[NH3+])=O)C(OC)=C3)=O)NC(OCC4=CC=CC=C4)=O)=O)C=C1OC)=O.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-]