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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H33FO5
Molecular Weight 432.5249
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOXIBETASOL PROPIONATE

SMILES

[H][C@@]12C[C@H](C)[C@](OC(=O)CC)(C(C)=O)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=ZAQGQQMIBBCIRM-RDEWRQEPSA-N
InChI=1S/C25H33FO5/c1-6-21(30)31-25(15(3)27)14(2)11-19-18-8-7-16-12-17(28)9-10-22(16,4)24(18,26)20(29)13-23(19,25)5/h9-10,12,14,18-20,29H,6-8,11,13H2,1-5H3/t14-,18-,19-,20-,22-,23-,24-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H33FO5
Molecular Weight 432.5249
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Doxybetasol is the corticosteroid. It is an impurity of Betamethasone, which is a glucocorticoid used as an anti-inflammatory agent. Doxybetasol also has anti-inflammatory and anti-allergic properties.

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:03:11 UTC 2023
Edited
by admin
on Fri Dec 15 15:03:11 UTC 2023
Record UNII
5J8MF9TDIU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOXIBETASOL PROPIONATE
Common Name English
CLOBETASOL PROPIONATE IMPURITY H [EP IMPURITY]
Common Name English
DOXIBETASOL 17-PROPIONATE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11.BETA.,17-DIHYDROXY-16.BETA.-METHYL-, 17-PROPIONATE
Systematic Name English
21-DEOXYBETAMETHASONE 17-PROPIONATE
Common Name English
GR 2/443
Code English
PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-, (11.BETA.,16.BETA.)-
Systematic Name English
21-DESOXY-BETAMETHASONE-17-PROPIONATE
Common Name English
GR-2/443
Code English
Code System Code Type Description
ECHA (EC/EINECS)
224-414-8
Created by admin on Fri Dec 15 15:03:11 UTC 2023 , Edited by admin on Fri Dec 15 15:03:11 UTC 2023
PRIMARY
PUBCHEM
107542
Created by admin on Fri Dec 15 15:03:11 UTC 2023 , Edited by admin on Fri Dec 15 15:03:11 UTC 2023
PRIMARY
CAS
4351-48-8
Created by admin on Fri Dec 15 15:03:11 UTC 2023 , Edited by admin on Fri Dec 15 15:03:11 UTC 2023
PRIMARY
FDA UNII
5J8MF9TDIU
Created by admin on Fri Dec 15 15:03:11 UTC 2023 , Edited by admin on Fri Dec 15 15:03:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID80878668
Created by admin on Fri Dec 15 15:03:11 UTC 2023 , Edited by admin on Fri Dec 15 15:03:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
ACTIVE MOIETY