Account Sodium 1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-2-(3-(1-(2-methoxyethyl)-3-methyl-5-sulfonato-3-(3-sulfonatopropyl)indolin-2-ylidene)prop-1-en-1-yl)-3-methyl-3-(3-sulfonatopropyl)-3H-indol-1-ium-5-sulfonate
- Catalog No. :
- ACFHFL835
- CAS No. :
- 1340586-78-8
- Molecular Formula :
- C40H48N3Na3O17S4
- Molecular Weight :
- 1040.07
IUPAC Name:sodium 1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-2-(3-(1-(2-methoxyethyl)-3-methyl-5-sulfonato-3-(3-sulfonatopropyl)indolin-2-ylidene)prop-1-en-1-yl)-3-methyl-3-(3-sulfonatopropyl)-3H-indol-1-ium-5-sulfonate
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Product Information
| Product Name | Sodium 1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-2-(3-(1-(2-methoxyethyl)-3-methyl-5-sulfonato-3-(3-sulfonatopropyl)indolin-2-ylidene)prop-1-en-1-yl)-3-methyl-3-(3-sulfonatopropyl)-3H-indol-1-ium-5-sulfonate |
|---|---|
| IUPAC Name | sodium 1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-2-(3-(1-(2-methoxyethyl)-3-methyl-5-sulfonato-3-(3-sulfonatopropyl)indolin-2-ylidene)prop-1-en-1-yl)-3-methyl-3-(3-sulfonatopropyl)-3H-indol-1-ium-5-sulfonate |
| Molecular Formula | C40H48N3Na3O17S4 |
| Molecular Weight | 1040.07 |
| SMILES | O=C(ON1C(CCC1=O)=O)CCCCC[N+]2=C(C(CCCS(=O)([O-])=O)(C3=C2C=CC(S(=O)([O-])=O)=C3)C)C=CC=C4N(C5=CC=C(C=C5C4(C)CCCS(=O)([O-])=O)S(=O)([O-])=O)CCOC.[Na+].[Na+].[Na+] |
| InChI Key | YCNNKFGNERTZHS-UHFFFAOYSA-K |
| Synonym | BP Light 550 NHS ester;3H-Indolium, 2-[3-[1,3-dihydro-1-(2-methoxyethyl)-3-methyl-5-sulfo-3-(3-sulfopropyl)-2H-indol-2-ylidene]-1-propen-1-yl]-1-[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-3-methyl-5-sulfo-3-(3-sulfopropyl)-, inner salt, sodium salt (1:3) |
| CAS No. | 1340586-78-8 |
Synthetic Route by SureRoute
2. ACFHFL835 Molecular Building Block Synthetic Route
Potassium 2-(5-(3,3-dimethyl-5-sulfonato-1-(4-sulfonatobutyl)indolin-2-ylidene)penta-1,3-dien-1-yl)-3-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-3-methyl-1-(4-sulfonatobutyl)-3H-indol-1-ium-5-sulfonate
3-(2-(3-(3,3-Dimethyl-5-sulfo-1-(3-sulfopropyl)indolin-2-ylidene)prop-1-en-1-yl)-3-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)-3-methyl-5-sulfo-3H-indol-1-ium-1-yl)propane-1-sulfonate
3-(2-(5-(3,3-Dimethyl-5-sulfo-1-(3-sulfopropyl)indolin-2-ylidene)penta-1,3-dien-1-yl)-3-(5-((2,5-dioxopyrrolidin-1-yl)oxy)-5-oxopentyl)-3-methyl-5-sulfo-3H-indol-1-ium-1-yl)propane-1-sulfonate