Analyte Name

Sodium 8,8'-((3,3'-((3,3'-(Carbonylbis(azanediyl))bis(benzoyl-2,4,5,6-d4))bis(azanediyl))bis(4-methylbenzoyl))bis(azanediyl))bis(naphthalene-1,3,5-trisulfonate)

Molecular Formula

C51H26D8N6Na6O23S6

Molecular Weight

1437.2

SMILES

CC1=C(C=C(C(NC2=C3C(C=C(S(=O)(O[Na])=O)C=C3S(=O)(O[Na])=O)=C(S(=O)(O[Na])=O)C=C2)=O)C=C1)NC(C4=C([2H])C(NC(NC5=C([2H])C([2H])=C([2H])C(C(NC6=C(C=CC(C(NC7=C8C(C=C(S(=O)(O[Na])=O)C=C8S(=O)(O[Na])=O)=C(S(=O)(O[Na])=O)C=C7)=O)=C6)C)=O)=C5[2H])=O)=C([2H])C([2H])=C4[2H])=O

InChI

InChI=1S/C51H40N6O23S6.6Na/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80;;;;;;/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80);;;;;;/q;6*+1/p-6/i3D,4D,5D,6D,7D,8D,17D,18D;;;;;;

SIL Type

Deuterium

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat