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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30F2O6
Molecular Weight 452.4882
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (6β,11β,16α)-6,9-Difluoro-11,21-dihydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)CO

InChI

InChIKey=FEBLZLNTKCEFIT-PXGYRYRDSA-N
InChI=1S/C24H30F2O6/c1-20(2)31-19-9-13-14-8-16(25)15-7-12(28)5-6-21(15,3)23(14,26)17(29)10-22(13,4)24(19,32-20)18(30)11-27/h5-7,13-14,16-17,19,27,29H,8-11H2,1-4H3/t13-,14-,16+,17-,19+,21-,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H30F2O6
Molecular Weight 452.4882
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:34:38 GMT 2023
Edited
by admin
on Sat Dec 16 19:34:38 GMT 2023
Record UNII
U43DJB8WEQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(6β,11β,16α)-6,9-Difluoro-11,21-dihydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
Systematic Name English
FLUOCINOLONE ACETONIDE IMPURITY J [EP IMPURITY]
Common Name English
Pregna-1,4-diene-3,20-dione, 6,9-difluoro-11,21-dihydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (6β,11β,16α)-
Systematic Name English
6β,9-difluoro-11β,21-dihydroxy-16α,17-(1-methylethylidenedioxy)pregna-1,4-diene-3,20-dione
Systematic Name English
Code System Code Type Description
CAS
1361531-95-4
Created by admin on Sat Dec 16 19:34:38 GMT 2023 , Edited by admin on Sat Dec 16 19:34:38 GMT 2023
PRIMARY
PUBCHEM
12897745
Created by admin on Sat Dec 16 19:34:38 GMT 2023 , Edited by admin on Sat Dec 16 19:34:38 GMT 2023
PRIMARY
FDA UNII
U43DJB8WEQ
Created by admin on Sat Dec 16 19:34:38 GMT 2023 , Edited by admin on Sat Dec 16 19:34:38 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY