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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24F2O5
Molecular Weight 382.3984
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of (3Z)-5-[(1R,2R,3R,5S)-2-[(1E)-3,3-Difluoro-4-phenoxy-1-buten-1-yl]-3,5-dihydroxycyclopentyl]-3-pentenoic acid

SMILES

O[C@H]1C[C@@H](O)[C@H](\C=C\C(F)(F)COC2=CC=CC=C2)[C@H]1C\C=C/CC(O)=O

InChI

InChIKey=ZEIXIGFOMTYCCY-DAMDRFSLSA-N
InChI=1S/C20H24F2O5/c21-20(22,13-27-14-6-2-1-3-7-14)11-10-16-15(17(23)12-18(16)24)8-4-5-9-19(25)26/h1-7,10-11,15-18,23-24H,8-9,12-13H2,(H,25,26)/b5-4-,11-10+/t15-,16-,17+,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H24F2O5
Molecular Weight 382.3984
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:56:35 UTC 2023
Edited
by admin
on Sat Dec 16 18:56:35 UTC 2023
Record UNII
8G2U6LRG4M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3Z)-5-[(1R,2R,3R,5S)-2-[(1E)-3,3-Difluoro-4-phenoxy-1-buten-1-yl]-3,5-dihydroxycyclopentyl]-3-pentenoic acid
Systematic Name English
TAFLUPROST METABOLITE (1,2-DINOR-AFP-172)
Common Name English
1,2-DINOR-AFP-172
Common Name English
3-Pentenoic acid, 5-[(1R,2R,3R,5S)-2-[(1E)-3,3-difluoro-4-phenoxy-1-buten-1-yl]-3,5-dihydroxycyclopentyl]-, (3Z)-
Systematic Name English
TAFLUPROST ACID METABOLITE (1,2-DINOR-AFP-172)
Common Name English
Code System Code Type Description
FDA UNII
8G2U6LRG4M
Created by admin on Sat Dec 16 18:56:35 UTC 2023 , Edited by admin on Sat Dec 16 18:56:35 UTC 2023
PRIMARY
CAS
1372444-82-0
Created by admin on Sat Dec 16 18:56:35 UTC 2023 , Edited by admin on Sat Dec 16 18:56:35 UTC 2023
PRIMARY
PUBCHEM
155928995
Created by admin on Sat Dec 16 18:56:35 UTC 2023 , Edited by admin on Sat Dec 16 18:56:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE