Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C53H69ClN2O14 |
| Molecular Weight | 993.573 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 1 |
| Charge | 2 |
SHOW SMILES / InChI
SMILES
COC1=CC(C[C@@H]2C3=CC(OC)=C(OC)C=C3CC[N@@+]2(C)CCCOC(=O)C(\Cl)=C\C(=O)OCCC[N@@+]4(C)CCC5=CC(OC)=C(OC)C=C5[C@@H]4C6=CC(OC)=C(OC)C(OC)=C6)=CC(OC)=C1OC
InChI
InChIKey=ZQLDXCSTJFLRPY-RWBXLJKRSA-N
InChI=1S/C53H69ClN2O14/c1-55(19-15-34-26-41(59-3)43(61-5)30-37(34)40(55)23-33-24-45(63-7)51(67-11)46(25-33)64-8)17-13-22-70-53(58)39(54)32-49(57)69-21-14-18-56(2)20-16-35-27-42(60-4)44(62-6)31-38(35)50(56)36-28-47(65-9)52(68-12)48(29-36)66-10/h24-32,40,50H,13-23H2,1-12H3/q+2/b39-32-/t40-,50+,55-,56+/m1/s1
| Molecular Formula | C53H69ClN2O14 |
| Molecular Weight | 993.573 |
| Charge | 2 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 4 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Gantacurium (GW280430A) is an ultrashort-acting neuromuscular blocking agent with a rapid onset and a wide safety margin, and is one of the most recent neuromuscular blocking agents that have shown potential for clinical application. It is an asymmetric enantiomeric isoquinolinium diester of chlorofumaric acid. The neuromuscular properties of gantacurium (such as spontaneous recovery of a neuromuscular block induced by the compound) were comparable with the depolarizing neuromuscular blocking drug succinylcholine, but without the unwanted side effects of this depolarizing neuromuscular blocking drug. Gantacurium is, due to its unique metabolism, rapidly inactivated by cysteine adduction and alkaline hydrolysis.
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 03:21:16 GMT 2023
by
admin
on
Sat Dec 16 03:21:16 GMT 2023
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| Record UNII |
N9VK9ZO25E
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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N9VK9ZO25E
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758669-50-0
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DB05710
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DTXSID90226772
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Gantacurium
Created by
admin on Sat Dec 16 03:21:16 GMT 2023 , Edited by admin on Sat Dec 16 03:21:16 GMT 2023
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10102486
Created by
admin on Sat Dec 16 03:21:16 GMT 2023 , Edited by admin on Sat Dec 16 03:21:16 GMT 2023
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| Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
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ACTIVE MOIETY |
