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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H24FNO6
Molecular Weight 453.4596
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AXITIROME, (R)-

SMILES

CCOC(=O)C(=O)NC1=CC(C)=C(OC2=CC([C@H](O)C3=CC=C(F)C=C3)=C(O)C=C2)C(C)=C1

InChI

InChIKey=FUBBWDWIGBTUPQ-JOCHJYFZSA-N
InChI=1S/C25H24FNO6/c1-4-32-25(31)24(30)27-18-11-14(2)23(15(3)12-18)33-19-9-10-21(28)20(13-19)22(29)16-5-7-17(26)8-6-16/h5-13,22,28-29H,4H2,1-3H3,(H,27,30)/t22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H24FNO6
Molecular Weight 453.4596
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:03:28 GMT 2023
Edited
by admin
on Sat Dec 16 09:03:28 GMT 2023
Record UNII
DGE1QD9BMH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AXITIROME, (R)-
Common Name English
ACETIC ACID, ((4-(3-((R)-(4-FLUOROPHENYL)HYDROXYMETHYL)-4-HYDROXYPHENOXY)-3,5-DIMETHYLPHENYL)AMINO)OXO-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
10026916
Created by admin on Sat Dec 16 09:03:28 GMT 2023 , Edited by admin on Sat Dec 16 09:03:28 GMT 2023
PRIMARY
CAS
156740-75-9
Created by admin on Sat Dec 16 09:03:28 GMT 2023 , Edited by admin on Sat Dec 16 09:03:28 GMT 2023
PRIMARY
FDA UNII
DGE1QD9BMH
Created by admin on Sat Dec 16 09:03:28 GMT 2023 , Edited by admin on Sat Dec 16 09:03:28 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER