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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H56N2O2
Molecular Weight 488.7885
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of DESDIACETYLPANCURONIUM

SMILES

[H][C@@]12C[C@@H]([C@H](O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@H](O)[C@H](C[C@]34C)[N+]5(C)CCCCC5)[N+]6(C)CCCCC6

InChI

InChIKey=LPXWONMTBVUBHC-OBIZLECESA-N
InChI=1S/C31H56N2O2/c1-30-14-13-24-23(25(30)20-26(29(30)35)32(3)15-7-5-8-16-32)12-11-22-19-28(34)27(21-31(22,24)2)33(4)17-9-6-10-18-33/h22-29,34-35H,5-21H2,1-4H3/q+2/t22-,23+,24-,25-,26-,27-,28-,29-,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H54N2O2
Molecular Weight 486.7727
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:24:29 GMT 2023
Edited
by admin
on Fri Dec 15 16:24:29 GMT 2023
Record UNII
4713E1J9XJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESDIACETYLPANCURONIUM
Common Name English
3,17-HYDROXYPANCURONIUM
Common Name English
3,17-DIHYDROXYPANCURONIUM
Common Name English
Code System Code Type Description
FDA UNII
4713E1J9XJ
Created by admin on Fri Dec 15 16:24:29 GMT 2023 , Edited by admin on Fri Dec 15 16:24:29 GMT 2023
PRIMARY
CAS
43021-46-1
Created by admin on Fri Dec 15 16:24:29 GMT 2023 , Edited by admin on Fri Dec 15 16:24:29 GMT 2023
PRIMARY
PUBCHEM
203948
Created by admin on Fri Dec 15 16:24:29 GMT 2023 , Edited by admin on Fri Dec 15 16:24:29 GMT 2023
PRIMARY
Related Record Type Details
IONIC MOIETY
Related Record Type Details
PARENT -> METABOLITE LESS ACTIVE
In bile too; Pancuronium is 54 times more potent than this metabolite
PLASMA; URINE