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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12O6.2Na
Molecular Weight 370.2638
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CINFENOAC DISODIUM

SMILES

[Na+].[Na+].[O-]C(=O)COC1=CC=C(C=C1)C(=O)\C=C\C2=CC=C(C=C2)C([O-])=O

InChI

InChIKey=LWRRBGAVOKITFT-PRAOPCELSA-L
InChI=1S/C18H14O6.2Na/c19-16(10-3-12-1-4-14(5-2-12)18(22)23)13-6-8-15(9-7-13)24-11-17(20)21;;/h1-10H,11H2,(H,20,21)(H,22,23);;/q;2*+1/p-2/b10-3+;;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H12O6
Molecular Weight 324.2843
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Cinfenoac is a chalcone derivative patented by a pharmaceutical company Biorex Laboratories from the UK. The compound is claimed for the treatment of inflammatory and allergic conditions, as well as for the treatment of the ulcerous condition of the gastrointestinal tract.

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:08:41 GMT 2023
Edited
by admin
on Sat Dec 16 20:08:41 GMT 2023
Record UNII
TYK2UY8GSL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CINFENOAC DISODIUM
Common Name English
Benzoic acid, 4-[3-[4-(carboxymethoxy)phenyl]-3-oxo-1-propenyl]-, disodium salt, (E)-
Systematic Name English
Code System Code Type Description
FDA UNII
TYK2UY8GSL
Created by admin on Sat Dec 16 20:08:41 GMT 2023 , Edited by admin on Sat Dec 16 20:08:41 GMT 2023
PRIMARY
CAS
68461-38-1
Created by admin on Sat Dec 16 20:08:41 GMT 2023 , Edited by admin on Sat Dec 16 20:08:41 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY