U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28NO3.Br
Molecular Weight 398.335
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GLYCOPYRROLATE, (2S,3'R)-

SMILES

[Br-].C[N+]1(C)CC[C@H](C1)OC(=O)[C@](O)(C2CCCC2)C3=CC=CC=C3

InChI

InChIKey=VPNYRYCIDCJBOM-POCMBTLOSA-M
InChI=1S/C19H28NO3.BrH/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3;1H/q+1;/p-1/t17-,19-;/m1./s1

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H27NO3
Molecular Weight 317.4226
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:30:19 UTC 2023
Edited
by admin
on Sat Dec 16 11:30:19 UTC 2023
Record UNII
VGB6MN0Z00
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GLYCOPYRROLATE, (2S,3'R)-
Common Name English
PYRROLIDINIUM, 3-(((2S)-2-CYCLOPENTYL-2-HYDROXY-2-PHENYLACETYL)OXY)-1,1-DIMETHYL-, BROMIDE (1:1), (3R)-
Systematic Name English
GLYCOPYRRONIUM BROMIDE, (2S,3'R)-
Common Name English
PYRROLIDINIUM, 3-((CYCLOPENTYLHYDROXYPHENYLACETYL)OXY)-1,1-DIMETHYL-, BROMIDE, (R-(R*,S*))-
Systematic Name English
PYRROLIDINIUM, 3-(((2S)-CYCLOPENTYLHYDROXYPHENYLACETYL)OXY)-1,1-DIMETHYL-, BROMIDE, (3R)-
Systematic Name English
(3R)-3-(((2S)-2-CYCLOPENTYL-2-HYDROXY-2-PHENYLACETYL)OXY)-1,1-DIMETHYLPYRROLIDINIUM BROMIDE (1:1)
Systematic Name English
GLYCOPYRROLATE, (R-(R*,S*))-
Common Name English
Code System Code Type Description
CAS
129784-11-8
Created by admin on Sat Dec 16 11:30:19 UTC 2023 , Edited by admin on Sat Dec 16 11:30:19 UTC 2023
PRIMARY
FDA UNII
VGB6MN0Z00
Created by admin on Sat Dec 16 11:30:19 UTC 2023 , Edited by admin on Sat Dec 16 11:30:19 UTC 2023
PRIMARY
PUBCHEM
9843787
Created by admin on Sat Dec 16 11:30:19 UTC 2023 , Edited by admin on Sat Dec 16 11:30:19 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
PARENT -> SALT/SOLVATE