Products 2714419-16-4

CAS 2714419-16-4 appears in our catalog under these names: Tetra-sulfo-Cy7DBCO, 98%, Tetra-sulfo-Cy7 DBCO. Offered by: Chemat Brand, MedChemExpress. Available pack sizes: on request, Get quote.

Tetra-sulfo-Cy7DBCO, 98%
Chemat Brand
  • size: on request
  • Variants: 1
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Tetra-sulfo-Cy7 DBCO
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

2-[2-[2-[4-[5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-5-oxopentyl]phenyl]-3-[2-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-2-ylidene]ethylidene]cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-(3-sulfopropyl)indol-1-ium-5-sulfonate (CAS 2714419-16-4) is a chemical compound with the molecular formula C65H70N4O14S4 and a molecular weight of 1259.5 g/mol. IUPAC name: 2-[2-[2-[4-[5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-5-oxopentyl]phenyl]-3-[2-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-2-ylidene]ethylidene]cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-(3-sulfopropyl)indol-1-ium-5-sulfonate. InChIKey: UKMSDIPVITUGAJ-UHFFFAOYSA-N.

Identity
Molecular formulaC65H70N4O14S4
Molecular weight1259.5 g/mol
IUPAC name2-[2-[2-[4-[5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-5-oxopentyl]phenyl]-3-[2-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-2-ylidene]ethylidene]cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-(3-sulfopropyl)indol-1-ium-5-sulfonate
InChIKeyUKMSDIPVITUGAJ-UHFFFAOYSA-N
SMILESCC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1C=CC3=C(C(=CC=C4C(C5=C(N4CCCS(=O)(=O)O)C=CC(=C5)S(=O)(=O)O)(C)C)CCC3)C6=CC=C(C=C6)CCCCC(=O)NCCC(=O)N7CC8=CC=CC=C8C#CC9=CC=CC=C97)CCCS(=O)(=O)O)C

Computed by PubChem (NCBI)

Synonyms: Tetra-sulfo-Cy7DBCO, orb3028502