Account Sodium 4-((2-(2-(3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)-3H-indol-1-ium-2-yl)vinyl)-6-(2-(3,3-dimethyl-1-(3-sulfonatopropyl)indolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)oxy)benzenesulfonate
- Catalog No. :
- ACYOFH747
- CAS No. :
- 2140857-96-9
- Molecular Formula :
- C45H50N2Na2O12S3
- Molecular Weight :
- 953.08
IUPAC Name:sodium 4-(((E)-6-(2-((E)-3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)indolin-2-ylidene)ethylidene)-2-((E)-2-(3,3-dimethyl-1-(3-sulfonatopropyl)-3H-indol-1-ium-2-yl)vinyl)cyclohex-1-en-1-yl)oxy)benzenesulfonate
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Product Information
| Product Name | Sodium 4-((2-(2-(3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)-3H-indol-1-ium-2-yl)vinyl)-6-(2-(3,3-dimethyl-1-(3-sulfonatopropyl)indolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)oxy)benzenesulfonate |
|---|---|
| IUPAC Name | sodium 4-(((E)-6-(2-((E)-3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)indolin-2-ylidene)ethylidene)-2-((E)-2-(3,3-dimethyl-1-(3-sulfonatopropyl)-3H-indol-1-ium-2-yl)vinyl)cyclohex-1-en-1-yl)oxy)benzenesulfonate |
| Molecular Formula | C45H50N2Na2O12S3 |
| Molecular Weight | 953.08 |
| SMILES | O=C(O)CCCC1(C2=C(C=CC=C2)[N+](CCCS(=O)([O-])=O)=C1C=CC3=C(OC4=CC=C(C=C4)S(=O)([O-])=O)C(CCC3)=CC=C5N(C6=C(C=CC=C6)C5(C)C)CCCS(=O)([O-])=O)C.[Na+].[Na+] |
| InChI Key | XWSWYINLTXJNDT-UHFFFAOYSA-L |
| Synonym | BP Light 800 carboxylic acid;3H-Indolium, 3-(3-carboxypropyl)-2-[2-[3-[2-[1,3-dihydro-3,3-dimethyl-1-(3-sulfopropyl)-2H-indol-2-ylidene]ethylidene]-2-(4-sulfophenoxy)-1-cyclohexen-1-yl]ethenyl]-3-methyl-1-(3-sulfopropyl)-, inner salt, sodium salt (1:2) |
| CAS No. | 2140857-96-9 |
Synthetic Route by SureRoute
2. ACYOFH747 Molecular Building Block Synthetic Route
Sodium 4-((6-(2-(3,3-dimethyl-1-(3-sulfonatopropyl)indolin-2-ylidene)ethylidene)-2-(2-(3-(4-((2,5-dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-3-methyl-1-(3-sulfonatopropyl)-3H-indol-1-ium-2-yl)vinyl)cyclohex-1-en-1-yl)oxy)benzenesulfonate
Sodium 6-(2-(2-(3-(2-(3,3-dimethyl-5-sulfonato-1-(4-sulfonatobutyl)-3H-indol-1-ium-2-yl)vinyl)-2-(4-sulfonatophenoxy)cyclohex-2-en-1-ylidene)ethylidene)-3,3-dimethyl-5-sulfonatoindolin-1-yl)hexanoate
Nerindocianine