tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate
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![tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8791727e62c1411bac34a601876647c8.png "tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate")
tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate
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CAS No:
2419286-92-1
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Formula:
C44H42K3N3O16S4
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Chemical Name:
tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate
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Synonyms:
sulfo-Cy5.5-NHS ester tripotassium salt;2419286-92-1
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CAS No:
tripotassium;(2E)-3-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-1,1-dimethyl-2-[(2E,4E)-5-(1,1,3-trimethyl-6,8-disulfonatobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]benzo[e]indole-6,8-disulfonate Basic Attributes
1114.4 g/mol
1113.0359114 g/mol
Computed Properties
Molecular Weight:1114.4
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:11
Exact Mass:1113.0359114
Monoisotopic Mass:1113.0359114
Topological Polar Surface Area:332
Heavy Atom Count:70
Complexity:2500
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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