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Details

Stereochemistry ACHIRAL
Molecular Formula C19H22O5S
Molecular Weight 362.44
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DES(BENZOFURANACETIC ACID) FASIGLIFAM BENZOIC ACID

SMILES

CC1=CC(OCCCS(C)(=O)=O)=CC(C)=C1C2=CC(=CC=C2)C(O)=O

InChI

InChIKey=TYOTUIMLIRAODC-UHFFFAOYSA-N
InChI=1S/C19H22O5S/c1-13-10-17(24-8-5-9-25(3,22)23)11-14(2)18(13)15-6-4-7-16(12-15)19(20)21/h4,6-7,10-12H,5,8-9H2,1-3H3,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C19H22O5S
Molecular Weight 362.44
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:05:32 UTC 2023
Edited
by admin
on Sat Dec 16 15:05:32 UTC 2023
Record UNII
N7VE3ADS8T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DES(BENZOFURANACETIC ACID) FASIGLIFAM BENZOIC ACID
Common Name English
(1,1'-BIPHENYL)-3-CARBOXYLIC ACID, 2',6'-DIMETHYL-4'-(3-(METHYLSULFONYL)PROPOXY)-
Systematic Name English
DES(BENZOFURANACETIC ACID) TAK-875 BENZOIC ACID
Common Name English
TAK-875 M1 METABOLITE
Code English
Code System Code Type Description
CAS
2244976-34-7
Created by admin on Sat Dec 16 15:05:32 UTC 2023 , Edited by admin on Sat Dec 16 15:05:32 UTC 2023
PRIMARY
PUBCHEM
137331906
Created by admin on Sat Dec 16 15:05:32 UTC 2023 , Edited by admin on Sat Dec 16 15:05:32 UTC 2023
PRIMARY
FDA UNII
N7VE3ADS8T
Created by admin on Sat Dec 16 15:05:32 UTC 2023 , Edited by admin on Sat Dec 16 15:05:32 UTC 2023
PRIMARY
Related Record Type Details
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