U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28ClFO5
Molecular Weight 426.906
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6?-Chlorodexamethasone

SMILES

C[C@@H]1C[C@H]2[C@@H]3C[C@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO

InChI

InChIKey=CDGJSUBGFOVZMH-GQKYHHCASA-N
InChI=1S/C22H28ClFO5/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-19(15,2)21(14,24)17(27)9-20(13,3)22(11,29)18(28)10-25/h4-5,7,11,13-14,16-17,25,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H28ClFO5
Molecular Weight 426.906
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 Wed Apr 02 17:21:45 GMT 2025
Edited
by admin
on Wed Apr 02 17:21:45 GMT 2025
Record UNII
9ABP366W82
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Flumethasone Impurity 2
Preferred Name English
6?-Chlorodexamethasone
Common Name English
Pregna-1,4-diene-3,20-dione, 6?-chloro-9-fluoro-11?,17,21-trihydroxy-16?-methyl-
Systematic Name English
(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6-chloro-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Systematic Name English
(6?,11?,16?)-6-Chloro-9-fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
Systematic Name English
Pregna-1,4-diene-3,20-dione, 6-chloro-9-fluoro-11,17,21-trihydroxy-16-methyl-, (6?,11?,16?)-
Systematic Name English
Code System Code Type Description
CAS
1744-64-5
Created by admin on Wed Apr 02 17:21:45 GMT 2025 , Edited by admin on Wed Apr 02 17:21:45 GMT 2025
PRIMARY
FDA UNII
9ABP366W82
Created by admin on Wed Apr 02 17:21:45 GMT 2025 , Edited by admin on Wed Apr 02 17:21:45 GMT 2025
PRIMARY
PUBCHEM
69421477
Created by admin on Wed Apr 02 17:21:45 GMT 2025 , Edited by admin on Wed Apr 02 17:21:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID301125076
Created by admin on Wed Apr 02 17:21:45 GMT 2025 , Edited by admin on Wed Apr 02 17:21:45 GMT 2025
PRIMARY