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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H35NO2
Molecular Weight 345.5188
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEXSECOVERINE

SMILES

CCN(CCCC(=O)C1CCCCC1)[C@@H](C)CC2=CC=C(OC)C=C2

InChI

InChIKey=WAVYHSURRZBQKO-SFHVURJKSA-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/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H35NO2
Molecular Weight 345.5188
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 17:20:46 GMT 2023
Edited
by admin
on Sat Dec 16 17:20:46 GMT 2023
Record UNII
3O6AUX3I0J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEXSECOVERINE
INN  
INN  
Official Name English
1-BUTANONE, 1-CYCLOHEXYL-4-(ETHYL(2-(4-METHOXYPHENYL)-1-METHYLETHYL)AMINO)-, (+)-
Systematic Name English
(+)-(S)-1-CYCLOHEXYL-4-(ETHYL(P-METHOXY-.ALPHA.-METHYLPHENETHYL)AMINO)-1-BUTANONE
Common Name English
SECOVERINE, (S)-
Common Name English
dexsecoverine [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
NCI_THESAURUS C29698
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
Code System Code Type Description
PUBCHEM
208824
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
FDA UNII
3O6AUX3I0J
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID201024752
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
NCI_THESAURUS
C73161
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
EVMPD
SUB07047MIG
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
INN
5735
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
SMS_ID
100000083432
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
CAS
90237-04-0
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104656
Created by admin on Sat Dec 16 17:20:46 GMT 2023 , Edited by admin on Sat Dec 16 17:20:46 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY