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Details

Stereochemistry RACEMIC
Molecular Formula C24H22FNO6
Molecular Weight 439.433
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KAT-681 FREE ACID

SMILES

CC1=CC(NC(=O)CC(O)=O)=CC(C)=C1OC2=CC=C(O)C(=C2)C(O)C3=CC=C(F)C=C3

InChI

InChIKey=GHKUCWZCPWQVQJ-UHFFFAOYSA-N
InChI=1S/C24H22FNO6/c1-13-9-17(26-21(28)12-22(29)30)10-14(2)24(13)32-18-7-8-20(27)19(11-18)23(31)15-3-5-16(25)6-4-15/h3-11,23,27,31H,12H2,1-2H3,(H,26,28)(H,29,30)

HIDE SMILES / InChI

Molecular Formula C24H22FNO6
Molecular Weight 439.433
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Inhibitory effects of KAT-681, a liver-selective thyromimetic, on development of hepatocellular proliferative lesions in rats induced by 2-acetylaminofluorene and partial hepatectomy after diethylnitrosamine initiation.
2004 Aug
Different inhibitory effects in the early and late phase of treatment with KAT-681, a liver-selective thyromimetic, on rat hepatocarcinogenesis induced by 2-acetylaminofluorene and partial hepatectomy after diethylnitrosamine initiation.
2005 Mar
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:39 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:39 GMT 2023
Record UNII
35P0W6HFHC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KAT-681 FREE ACID
Common Name English
PROPANOIC ACID, 3-((4-(3-((4-FLUOROPHENYL)HYDROXYMETHYL)-4-HYDROXYPHENOXY)-3,5-DIMETHYLPHENYL)AMINO)-3-OXO-
Systematic Name English
Code System Code Type Description
PUBCHEM
9847968
Created by admin on Sat Dec 16 08:02:39 GMT 2023 , Edited by admin on Sat Dec 16 08:02:39 GMT 2023
PRIMARY
FDA UNII
35P0W6HFHC
Created by admin on Sat Dec 16 08:02:39 GMT 2023 , Edited by admin on Sat Dec 16 08:02:39 GMT 2023
PRIMARY
CAS
364332-60-5
Created by admin on Sat Dec 16 08:02:39 GMT 2023 , Edited by admin on Sat Dec 16 08:02:39 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY