9-[4-[[[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]amino]sulfonyl]-2-sulfophenyl]-2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-Xantheno[2,3,4-ij:5,6,7-i'j']diquinolizin-18-ium inner salt, ≥98%

cas: 178623-11-5 — see every product listed under this CAS number, including other names

9-[4-[[[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]amino]sulfonyl]-2-sulfophenyl]-2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-Xantheno[2,3,4-ij:5,6,7-i'j']diquinolizin-18-ium inner salt, ≥98% (CAS 178623-11-5) is a chemical reagent available from Chemat. Available pack sizes: 5mg. Offered by: Chemat.

• 2D
• 3D

5-[[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]sulfamoyl]-2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzenesulfonate (CAS 178623-11-5) is a chemical compound with the molecular formula C41H44N4O10S2 and a molecular weight of 816.9 g/mol. IUPAC name: 5-[[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]sulfamoyl]-2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzenesulfonate. InChIKey: XTKWFJCUACVTMF-UHFFFAOYSA-N.

Identity

Molecular formula	C41H44N4O10S2
Molecular weight	816.9 g/mol
IUPAC name	5-[[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]sulfamoyl]-2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzenesulfonate
InChIKey	XTKWFJCUACVTMF-UHFFFAOYSA-N
SMILES	C1CC2=CC3=C(C4=C2N(C1)CCC4)OC5=C6CCC[N+]7=C6C(=CC5=C3C8=C(C=C(C=C8)S(=O)(=O)NCCCCCC(=O)ON9C(=O)CCC9=O)S(=O)(=O)[O-])CCC7

Computed by PubChem (NCBI)

Synonyms: Texas Red-X succinimidyl ester, Texas red-X 4-succinimidyl ester, TR-X-NHS ester, 5-isomer, TR X NHS ester, 5-isomer, orb2565182