Products 2588467-47-2
CAS 2588467-47-2 is the registry number for AF 647-DBCO, 97%, 97%. Offered by: Chemat. Available pack sizes: 250mg, 100mg.
3-[(2Z)-3-[6-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-6-oxohexyl]-2-[(2E,4E)-5-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-1-ium-2-yl]penta-2,4-dienylidene]-3-methyl-5-sulfoindol-1-yl]propane-1-sulfonate (CAS 2588467-47-2) is a chemical compound with the molecular formula C54H60N4O14S4 and a molecular weight of 1117.3 g/mol. IUPAC name: 3-[(2Z)-3-[6-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-6-oxohexyl]-2-[(2E,4E)-5-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-1-ium-2-yl]penta-2,4-dienylidene]-3-methyl-5-sulfoindol-1-yl]propane-1-sulfonate. InChIKey: QBMNWVTZEUBNJC-UHFFFAOYSA-N.
| Molecular formula | C54H60N4O14S4 |
|---|---|
| Molecular weight | 1117.3 g/mol |
| IUPAC name | 3-[(2Z)-3-[6-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-6-oxohexyl]-2-[(2E,4E)-5-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-1-ium-2-yl]penta-2,4-dienylidene]-3-methyl-5-sulfoindol-1-yl]propane-1-sulfonate |
| InChIKey | QBMNWVTZEUBNJC-UHFFFAOYSA-N |
| SMILES | CC1(C2=C(C=CC(=C2)S(=O)(=O)O)[N+](=C1/C=C/C=C/C=C\3/C(C4=C(N3CCCS(=O)(=O)[O-])C=CC(=C4)S(=O)(=O)O)(C)CCCCCC(=O)NCCC(=O)N5CC6=CC=CC=C6C#CC7=CC=CC=C75)CCCS(=O)(=O)O)C |
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