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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H13FO4
Molecular Weight 276.2597
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3'-4'-DIHYDROXYFLURBIPROFEN, (S)-

SMILES

C[C@H](C(O)=O)C1=CC(F)=C(C=C1)C2=CC=C(O)C(O)=C2

InChI

InChIKey=PXJMZAQJKURKMR-QMMMGPOBSA-N
InChI=1S/C15H13FO4/c1-8(15(19)20)9-2-4-11(12(16)6-9)10-3-5-13(17)14(18)7-10/h2-8,17-18H,1H3,(H,19,20)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H13FO4
Molecular Weight 276.2597
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 08:49:56 UTC 2023
Edited
by admin
on Sat Dec 16 08:49:56 UTC 2023
Record UNII
1786DXB9P5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3'-4'-DIHYDROXYFLURBIPROFEN, (S)-
Common Name English
(1,1'-BIPHENYL)-4-ACETIC ACID, 2-FLUORO-3',4'-DIHYDROXY-.ALPHA.-METHYL-, (.ALPHA.S)-
Systematic Name English
Code System Code Type Description
CAS
124027-44-7
Created by admin on Sat Dec 16 08:49:56 UTC 2023 , Edited by admin on Sat Dec 16 08:49:56 UTC 2023
PRIMARY
PUBCHEM
92287473
Created by admin on Sat Dec 16 08:49:56 UTC 2023 , Edited by admin on Sat Dec 16 08:49:56 UTC 2023
PRIMARY
FDA UNII
1786DXB9P5
Created by admin on Sat Dec 16 08:49:56 UTC 2023 , Edited by admin on Sat Dec 16 08:49:56 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER