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

Details

Stereochemistry RACEMIC
Molecular Formula C22H35NO2
Molecular Weight 345.5188
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SECOVERINE

SMILES

CCN(CCCC(=O)C1CCCCC1)C(C)CC2=CC=C(OC)C=C2

InChI

InChIKey=WAVYHSURRZBQKO-UHFFFAOYSA-N
InChI=1S/C22H35NO2/c1-4-23(16-8-11-22(24)20-9-6-5-7-10-20)18(2)17-19-12-14-21(25-3)15-13-19/h12-15,18,20H,4-11,16-17H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C22H35NO2
Molecular Weight 345.5188
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Secoverine is a selective muscarinic receptor antagonist that was studied as a neurotropic spasmolytic agent. It was shown that the drug had no nicotinolytic or antihistaminic activity, a moderate antisterotonic activity, an inhibiting effect on the noradrenaline uptake mechanism of the vas deferens and marked local anesthetic activity.

Approval Year

PubMed

PubMed

TitleDatePubMed
Comparison of the affinity of secoverine for some muscarinic receptors.
1985 Jan-Feb
Secoverine is a non-selective muscarinic antagonist on rat heart and brain receptors.
1986 Aug 7
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:32:04 GMT 2023
Edited
by admin
on Fri Dec 15 17:32:04 GMT 2023
Record UNII
512WJG3I0O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SECOVERINE
INN  
INN  
Official Name English
1-CYCLOHEXYL-4-(ETHYL(P-METHOXY-.ALPHA.-METHYLPHENETHYL)AMINO)-1-BUTANONE
Common Name English
1-BUTANONE, 1-CYCLOHEXYL-4-(ETHYL(2-(4-METHOXYPHENYL)-1-METHYLETHYL)AMINO)-
Systematic Name English
secoverine [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
NCI_THESAURUS C29698
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
Code System Code Type Description
CAS
57558-44-8
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
ChEMBL
CHEMBL2105414
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID90866632
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
FDA UNII
512WJG3I0O
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
NCI_THESAURUS
C97981
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
SMS_ID
100000084085
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
CAS
119515-08-1
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
SUPERSEDED
INN
4321
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
MESH
C028187
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
EVMPD
SUB10469MIG
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
PUBCHEM
42470
Created by admin on Fri Dec 15 17:32:04 GMT 2023 , Edited by admin on Fri Dec 15 17:32:04 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY