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Details

Stereochemistry RACEMIC
Molecular Formula C20H29NO3
Molecular Weight 331.4492
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IPRAGRATINE

SMILES

CC(C)N1[C@H]2CCC[C@@H]1C[C@@H](C2)OC(=O)[C@@H](CO)C3=CC=CC=C3

InChI

InChIKey=ANNPRBHGSWBYLD-DXPBQALJSA-N
InChI=1S/C20H29NO3/c1-14(2)21-16-9-6-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-4-3-5-8-15/h3-5,7-8,14,16-19,22H,6,9-13H2,1-2H3/t16-,17?,18+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H29NO3
Molecular Weight 331.4492
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Ipragratine is azabicyclo[3.3.1]nonyl derivative patented by German pharmaceutical company Boehringer Ingelheim G.m.b.H. as central anticholinergics and spasmolytics.

Originator

Sources: ZA6705252 "Tropic acid derivatives"; Banholzer, Rolf; Hausner, Alex; Korndoerfer, Otto; Schulz, Werner; Walther, Gerhard; Zeite, Karl

Approval Year

PubMed

PubMed

TitleDatePubMed
[A new method for technical synthesis of tertiary and quaternary d,1-tropic acid esters of some N-subsituted nortropan- and granatan-3-oles (author's transl)].
1976
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:30:32 UTC 2023
Edited
by admin
on Fri Dec 15 16:30:32 UTC 2023
Record UNII
DO67LC8FVT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IPRAGRATINE
INN  
INN  
Official Name English
9-ISOPROPYLGRANATOLINE (±)-TROPATE (ESTER)
Common Name English
ipragratine [INN]
Common Name English
Code System Code Type Description
INN
3956
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
EVMPD
SUB08274MIG
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
SMS_ID
100000083121
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
NCI_THESAURUS
C170077
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
CAS
22150-28-3
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID101043222
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
ChEMBL
CHEMBL2107524
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
FDA UNII
DO67LC8FVT
Created by admin on Fri Dec 15 16:30:32 UTC 2023 , Edited by admin on Fri Dec 15 16:30:32 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY