Products 2762752-63-4
CAS 2762752-63-4 appears in our catalog under these names: BPFluor546 DBCO, 95%, BP Fluor 546 DBCO. Offered by: Chemat Brand, MedChemExpress. Available pack sizes: on request, Get quote.
13-[5-[2-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-2-oxoethyl]sulfanyl-2-carboxy-3,4,6-trichlorophenyl]-7,7,9,17,19,19-hexamethyl-22-sulfo-2-oxa-6-aza-20-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3(12),4,10,13,15,20-heptaene-4-sulfonate (CAS 2762752-63-4) is a chemical compound with the molecular formula C52H47Cl3N4O11S3 and a molecular weight of 1106.5 g/mol. IUPAC name: 13-[5-[2-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-2-oxoethyl]sulfanyl-2-carboxy-3,4,6-trichlorophenyl]-7,7,9,17,19,19-hexamethyl-22-sulfo-2-oxa-6-aza-20-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3(12),4,10,13,15,20-heptaene-4-sulfonate. InChIKey: JVEBSIZOSZJGCF-UHFFFAOYSA-N.
| Molecular formula | C52H47Cl3N4O11S3 |
|---|---|
| Molecular weight | 1106.5 g/mol |
| IUPAC name | 13-[5-[2-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-2-oxoethyl]sulfanyl-2-carboxy-3,4,6-trichlorophenyl]-7,7,9,17,19,19-hexamethyl-22-sulfo-2-oxa-6-aza-20-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3(12),4,10,13,15,20-heptaene-4-sulfonate |
| InChIKey | JVEBSIZOSZJGCF-UHFFFAOYSA-N |
| SMILES | CC1CC(NC2=C(C3=C(C=C12)C(=C4C=C5C(CC([NH+]=C5C(=C4O3)S(=O)(=O)O)(C)C)C)C6=C(C(=C(C(=C6Cl)SCC(=O)NCCC(=O)N7CC8=CC=CC=C8C#CC9=CC=CC=C97)Cl)Cl)C(=O)O)S(=O)(=O)[O-])(C)C |
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