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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28NO3
Molecular Weight 318.4305
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 1

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

SMILES

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

InChI

InChIKey=ANGKOCUUWGHLCE-PKOBYXMFSA-N
InChI=1S/C19H28NO3/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/q+1/t17-,19+/m0/s1

HIDE SMILES / InChI

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 11:29:05 GMT 2023
Edited
by admin
on Sat Dec 16 11:29:05 GMT 2023
Record UNII
0XQ5NT70ET
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GLYCOPYRRONIUM, (2S,3'S)-
Common Name English
PYRROLIDINIUM, 3-(((2S)-2-CYCLOPENTYL-2-HYDROXY-2-PHENYLACETYL)OXY)-1,1-DIMETHYL-, (3S)-
Systematic Name English
PYRROLIDINIUM, 3-((CYCLOPENTYLHYDROXYPHENYLACETYL)OXY)-1,1-DIMETHYL-, (S-(R*,R*))-
Systematic Name English
GLYCOPYRRONIUM, (S-(R*,R*))-
Common Name English
GLYCOPYRRONIUM CATION, (2S,3'S)-
Common Name English
PYRROLIDINIUM, 3-(((2S)-CYCLOPENTYLHYDROXYPHENYLACETYL)OXY)-1,1-DIMETHYL-, (3S)-
Systematic Name English
GLYCOPYRRONIUM ION, (2S,3'S)-
Common Name English
Code System Code Type Description
CAS
754152-54-0
Created by admin on Sat Dec 16 11:29:05 GMT 2023 , Edited by admin on Sat Dec 16 11:29:05 GMT 2023
PRIMARY
FDA UNII
0XQ5NT70ET
Created by admin on Sat Dec 16 11:29:05 GMT 2023 , Edited by admin on Sat Dec 16 11:29:05 GMT 2023
PRIMARY
PUBCHEM
16413919
Created by admin on Sat Dec 16 11:29:05 GMT 2023 , Edited by admin on Sat Dec 16 11:29:05 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
RACEMATE -> ENANTIOMER
SALT/SOLVATE -> PARENT