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Details

Stereochemistry ACHIRAL
Molecular Formula C31H31F2NO5
Molecular Weight 535.5783
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SCOPINAST

SMILES

COC1=CC2=C(OC(=O)C=C2)C=C1OCCCN3CCC(CC3)C(O)(C4=CC=C(F)C=C4)C5=CC=C(F)C=C5

InChI

InChIKey=JRXHLMMVJSXXHZ-UHFFFAOYSA-N
InChI=1S/C31H31F2NO5/c1-37-28-19-21-3-12-30(35)39-27(21)20-29(28)38-18-2-15-34-16-13-24(14-17-34)31(36,22-4-8-25(32)9-5-22)23-6-10-26(33)11-7-23/h3-12,19-20,24,36H,2,13-18H2,1H3

HIDE SMILES / InChI

Molecular Formula C31H31F2NO5
Molecular Weight 535.5783
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Scopinast (previously known as KA 398) was studied for the treatment of asthma and allergic seasonal. However, the further development of the drug was discontinued.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:35:08 GMT 2023
Edited
by admin
on Fri Dec 15 15:35:08 GMT 2023
Record UNII
LZ9041E1BO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SCOPINAST
INN  
INN  
Official Name English
scopinast [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29712
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2105407
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID50163098
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
PUBCHEM
3058748
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
NCI_THESAURUS
C75143
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
FDA UNII
LZ9041E1BO
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
CAS
145574-90-9
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
SMS_ID
100000084082
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
INN
7452
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
EVMPD
SUB10462MIG
Created by admin on Fri Dec 15 15:35:08 GMT 2023 , Edited by admin on Fri Dec 15 15:35:08 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY