Monothio Sugammadex Sodium

CAS: 343306-79-6

Ref. TR-M567283

Product Information

• Name: Monothio Sugammadex Sodium
• Synonyms: 6-Deoxy-6-thio-heptakis(6-deoxy-6-(2-carboxyethyl)thio)-gammacyclodextrin
• Brand: TRC
• Description: Stability HygroscopicApplications Monothio Sugammadex Sodium is an impurity of Sugammadex Sodium (S698100), which is the first in a class of drugs called selective relaxant binding agents that offers improved termination of the paralytic effects of neuromuscular blocking agents and may have many potential peri-operative benefits.References Welliver, M., et al.: Drug Des. Devel. Ther., 2, 49 (2008)

Chemical properties

• Molecular weight: 1930.09
• Formula: C₆₉H₁₀₈O₄₆S₈•xNa
• Color/Form: Neat
• InChI: InChI=1S/C69H108O46S8/c70-31(71)1-8-117-16-24-55-40(86)48(94)64(102-24)111-57-26(18-119-10-3-33(74)75)104-66(50(96)42(57)88)113-59-28(20-121-12-5-35(78)79)106-68(52(98)44(59)90)115-61-30(22-123-14-7-37(82)83)107-69(53(99)45(61)91)114-60-29(21-122-13-6-36(80)81)105-67(51(97)43(60)89)112-58-27(19-120-11-4-34(76)77)103-65(49(95)41(58)87)110-56-25(17-118-9-2-32(72)73)101-63(47(93)39(56)85)108-54-23(15-116)100-62(109-55)46(92)38(54)84/h23-30,38-69,84-99,116H,1-22H2,(H,70,71)(H,72,73)(H,74,75)(H,76,77)(H,78,79)(H,80,81)(H,82,83)/t23-,24-,25-,26-,27-,28-,29-,30-,38-,39-,40-,41?,42?,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68?,69-/m1/s1
• InChI key: InChIKey=WNIHGHUTZOVWBB-VBQUADHWSA-N
• SMILES: O=C(O)CCSC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CSCCC(=O)O)OC(O[C@@H]4[C@@H](CSCCC(=O)O)O[C@H](O[C@@H]5[C@@H](CSCCC(=O)O)O[C@H](O[C@H]6C(O)[C@@H](O)[C@H](O[C@@H]6CSCCC(=O)O)O[C@@H]6[C@@H](CSCCC(=O)O)O[C@H](O[C@@H]7[C@@H](CS)O[C@H](O[C@@H]8[C@@H](CSCCC(=O)O)O[C@H](O[C@H]1C(O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O