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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H26F2O5
Molecular Weight 420.4463
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione, (6?,11?)-

SMILES

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C

InChI

InChIKey=YXASFOVLXBFEEU-LKVAYOKUSA-N
InChI=1S/C23H26F2O5/c1-12(26)30-11-19(28)15-5-4-14-16-9-18(24)17-8-13(27)6-7-22(17,3)23(16,25)20(29)10-21(14,15)2/h5-8,14,16,18,20,29H,4,9-11H2,1-3H3/t14-,16-,18-,20-,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Difluprednate Impurity 16
Preferred Name English
21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione, (6?,11?)-
Systematic Name English
Pregna-1,4,16-triene-3,20-dione, 6?,9-difluoro-11?,21-dihydroxy-, 21-acetate
Systematic Name English
(6?,11?)-21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione
Systematic Name English
Pregna-1,4,16-triene-3,20-dione, 21-(acetyloxy)-6,9-difluoro-11-hydroxy-, (6?,11?)-
Systematic Name English
2-((6S,8S,9R,10S,11S,13S,14S)-6,9-difluoro-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15-decahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
102243
Created by admin on Wed Apr 02 17:54:42 GMT 2025 , Edited by admin on Wed Apr 02 17:54:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID10945953
Created by admin on Wed Apr 02 17:54:42 GMT 2025 , Edited by admin on Wed Apr 02 17:54:42 GMT 2025
PRIMARY
CAS
2326-26-3
Created by admin on Wed Apr 02 17:54:42 GMT 2025 , Edited by admin on Wed Apr 02 17:54:42 GMT 2025
PRIMARY
FDA UNII
B3QNX9A6DQ
Created by admin on Wed Apr 02 17:54:42 GMT 2025 , Edited by admin on Wed Apr 02 17:54:42 GMT 2025
PRIMARY