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

Details

Stereochemistry ABSOLUTE
Molecular Formula C26H30NO4S2
Molecular Weight 484.651
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of ACLIDINIUM

SMILES

OC(C(=O)O[C@H]1C[N+]3(CCCOC2=CC=CC=C2)CCC1CC3)(C4=CC=CS4)C5=CC=CS5

InChI

InChIKey=ASMXXROZKSBQIH-VITNCHFBSA-N
InChI=1S/C26H30NO4S2/c28-25(26(29,23-9-4-17-32-23)24-10-5-18-33-24)31-22-19-27(14-11-20(22)12-15-27)13-6-16-30-21-7-2-1-3-8-21/h1-5,7-10,17-18,20,22,29H,6,11-16,19H2/q+1/t20?,22-,27?/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H29NO4S2
Molecular Weight 483.643
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:34:29 UTC 2023
Edited
by admin
on Fri Dec 15 15:34:29 UTC 2023
Record UNII
K17VY42F6C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACLIDINIUM
VANDF   WHO-DD  
Common Name English
Aclidinium [WHO-DD]
Common Name English
(3R)-3-(2-HYDROXY(DI-2-THIENYL)ACETOXY)-1-(3-PHENOXYPROPYL)-1-AZONIABICYCLO(2.2.2)OCTANE
Systematic Name English
ACLIDINIUM [VANDF]
Common Name English
ACLIDINIUM CATION
Common Name English
ACLIDINIUM ION
Common Name English
1-AZONIABICYCLO(2.2.2)OCTANE, 3-((HYDROXYDI-2-THIENYLACETYL)OXY)-1-(3-PHENOXYPROPYL)-, (3R)-
Systematic Name English
Classification Tree Code System Code
EMA ASSESSMENT REPORTS BRIMICA GENUAIR ( AUTHORIZED: PLUMONARY DISEASE, CRONIC OBSTRUCTIVE)
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
WHO-ATC R03BB05
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
NDF-RT N0000175574
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
NCI_THESAURUS C29704
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
WHO-ATC R03AL05
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
Code System Code Type Description
DAILYMED
K17VY42F6C
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
SMS_ID
100000135703
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
CAS
727649-81-2
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
PUBCHEM
11434515
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID00223070
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
DRUG BANK
DB08897
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
LACTMED
Aclidinium
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
IUPHAR
7449
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
EVMPD
SUB71686
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
WIKIPEDIA
Aclidinium
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
RXCUI
1303098
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C79894
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
FDA UNII
K17VY42F6C
Created by admin on Fri Dec 15 15:34:29 UTC 2023 , Edited by admin on Fri Dec 15 15:34:29 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Ki
TARGET -> INHIBITOR
Ki
TARGET -> INHIBITOR
Ki
TARGET->ANTAGONIST
Ki
SALT/SOLVATE -> PARENT
EXCRETED UNCHANGED
URINE
TARGET -> INHIBITOR
Ki
Related Record Type Details
METABOLITE -> PARENT
in healthy subjects
MAJOR
FECAL; PLASMA; URINE
METABOLITE -> PARENT
MAJOR
FECAL; PLASMA
METABOLITE -> PARENT
METABOLITE -> PARENT
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Biological Half-life PHARMACOKINETIC
Tmax PHARMACOKINETIC
Volume of Distribution PHARMACOKINETIC