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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H55N2O3
Molecular Weight 515.7907
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 11
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of 17-DEACETYL VECURONIUM

SMILES

CC(=O)O[C@H]1C[C@@H]2CC[C@H]3[C@@H]4C[C@@H]([C@H](O)[C@@]4(C)CC[C@@H]3[C@@]2(C)C[C@@H]1N5CCCCC5)[N+]6(C)CCCCC6

InChI

InChIKey=VFOIZESKBJXLLL-OOJCLDBCSA-N
InChI=1S/C32H55N2O3/c1-22(35)37-29-19-23-11-12-24-25(32(23,3)21-27(29)33-15-7-5-8-16-33)13-14-31(2)26(24)20-28(30(31)36)34(4)17-9-6-10-18-34/h23-30,36H,5-21H2,1-4H3/q+1/t23-,24+,25-,26-,27-,28-,29-,30-,31-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula C32H54N2O3
Molecular Weight 514.7828
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 10 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:50:31 GMT 2025
Edited
by admin
on Mon Mar 31 22:50:31 GMT 2025
Record UNII
88NY989551
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
17-DEACETYLVECURONIUM CATION
Preferred Name English
17-DEACETYL VECURONIUM
Common Name English
VECURONIUM BROMIDE IMPURITY E [EP IMPURITY]
Common Name English
PIPERIDINIUM, 1-((2.BETA.,3.ALPHA.,5.ALPHA.,16.BETA.,17.BETA.)-3-(ACETYLOXY)-17-HYDROXY-2-(1-PIPERIDINYL)ANDROSTAN-16-YL)-1-METHYL-
Systematic Name English
1-(3.ALPHA.-(ACETYLOXY)-17.BETA.-HYDROXY-2.BETA.-(PIPERIDIN-1-YL)-5.ALPHA.-ANDROSTAN-16.BETA.-YL)-1-METHYLPIPERIDINIUM
Systematic Name English
VECURONIUM BROMIDE RELATED COMPOUND B CATION
Common Name English
Code System Code Type Description
CAS
784988-81-4
Created by admin on Mon Mar 31 22:50:31 GMT 2025 , Edited by admin on Mon Mar 31 22:50:31 GMT 2025
PRIMARY
PUBCHEM
14029406
Created by admin on Mon Mar 31 22:50:31 GMT 2025 , Edited by admin on Mon Mar 31 22:50:31 GMT 2025
PRIMARY
FDA UNII
88NY989551
Created by admin on Mon Mar 31 22:50:31 GMT 2025 , Edited by admin on Mon Mar 31 22:50:31 GMT 2025
PRIMARY
Related Record Type Details
IONIC MOIETY
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
PARENT -> IMPURITY