1H-Benz[e]indolium, 2-[5-[3-[6-[[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]amino]-6-oxohexyl]-1,3-dihydro-1,1-dimethyl-6,8-disulfo-2H-benz[e]indol-2-ylidene]-1,3-pentadien-1-yl]-3-ethyl-1,1-dimethyl-6,8-disulfo-, inner salt,1173009-37-4-Amadis Chemical

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[CAS No.1173009-37-4] A1104191 1H-Benz[e]indolium, 2-[5-[3-[6-[[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]amino]-6-oxohexyl]-1,3-dihydro-1,1-dimethyl-6,8-disulfo-2H-benz[e]indol-2-ylidene]-1,3-pentadien-1-yl]-3-ethyl-1,1-dimethyl-6,8-disulfo-, inner salt 97%

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Catalog No.: A1104191

Cas No.: 1173009-37-4

Molecular Formula: C₄₇H₅₀N₄O₁₅S₄

Molecular Weight: 1,039.18

MDL NO:

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Storage: Store in 2-8°C for long term (months)

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Smiles: CC1(C(N(CCCCCC(=O)NCCN2C(C=CC2=O)=O)C2C=CC3=C(C=C(S(O)(=O)=O)C=C3C1=2)S(O)(=O)=O)=CC=CC=CC1C(C2C3=CC(S(O)(=O)=O)=CC(S([O-])(=O)=O)=C3C=CC=2[N+]=1CC)(C)C)C

InchiKey: AQRFSKNRMKXSOH-UHFFFAOYSA-N

Inchi: InChI=1S/C47H50N4O15S4/c1-6-49-35-18-16-31-33(25-29(67(55,56)57)27-37(31)69(61,62)63)44(35)46(2,3)39(49)13-9-7-10-14-40-47(4,5)45-34-26-30(68(58,59)60)28-38(70(64,65)66)32(34)17-19-36(45)50(40)23-12-8-11-15-41(52)48-22-24-51-42(53)20-21-43(51)54/h7,9-10,13-14,16-21,25-28H,6,8,11-12,15,22-24H2,1-5H3,(H4-,48,52,55,56,57,58,59,60,61,62,63,64,65,66)

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