BGC > Product Search > Cisatracurium besylate | 96946-42-8

Molecular Formula: C53H72N2O12.2C6H5O3S
Molecular Weight: 1243.49
Hazard Symbols: T
UN Number: UN 2811 6.1 / PGIII
WGKGermany: 3
HS Code: 29145090

Description:
Cisatracurium besilate is a neuromuscular blocking agent that is used in liver transplant patient with safety. Cisatracurium besilate is also an enantiomer of Atracurium Besilate.

• Molecular Weight:1243.487
• Melting Point:90-93°C
• Purity:99%

Molecular Formula:
C65H82N2O18S2
Canonical SMILES:
C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)CC[N+]4(CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]
InChI:
InChI=1S/C53H72N2O12.2C6H6O3S/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6;2*7-10(8,9)6-4-2-1-3-5-6/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3;2*1-5H,(H,7,8,9)/q+2;;/p-2/t42-,43+,54-,55+;;
InChIKey:
XXZSQOVSEBAPGS-UDVWXPNDSA-L
Appearance:
White to Off-White Solid
Application:
neuromuscular blocking agent
Synonyms:
(1R,1'R,2R,2'R)-2,2'-[1,5-Pentanediylbis[oxy(3-oxo-3,1-propanediyl)]]bis[1-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-isoquinolinium dibenzenesulfonate; Cisatracurium besylate

Purity: 98%
Smile code: O=C(OCCCCCOC(CC[N@+]1(C)[C@H](CC2=CC=C(OC)C(OC)=C2)C3=C(C=C(OC)C(OC)=C3)CC1)=O)CC[N@+]4(C)[C@H](CC5=CC=C(OC)C(OC)=C5)C6=C(C=C(OC)C(OC)=C6)CC4.O=S(C7=CC=CC=C7)([O-])=O.O=S(C8=CC=CC=C8)([O-])=O
MDL Number: MFCD00871018
MolFormula: C65H82N2O18S2
MolWeight: 1243.4792
Available in stock: 8.65