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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H34ClFO5
Molecular Weight 468.986
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (11.BETA.,16.BETA.)-21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)PREGN-4-ENE-3,20-DIONE

SMILES

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

InChI

InChIKey=WWKWSAYUTWRZKP-XGQKBEPLSA-N
InChI=1S/C25H34ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h11,14,17-19,29H,5-10,12-13H2,1-4H3/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H34ClFO5
Molecular Weight 468.986
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:40:46 UTC 2023
Edited
by admin
on Sat Dec 16 15:40:46 UTC 2023
Record UNII
KD92YL1IS2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(11.BETA.,16.BETA.)-21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)PREGN-4-ENE-3,20-DIONE
Systematic Name English
21-CHLORO-9-FLUORO-11.BETA.-HYDROXY-16.BETA.-METHYL-3,20-DIOXOPREGN-4-EN-17-YL PROPANOATE
Systematic Name English
1,2-DIHYDROCLOBETASOL 17-PROPIONATE
Common Name English
PREGN-4-ENE-3,20-DIONE, 21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-, (11.BETA.,16.BETA.)-
Systematic Name English
CLOBETASOL PROPIONATE IMPURITY D [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
129627414
Created by admin on Sat Dec 16 15:40:46 UTC 2023 , Edited by admin on Sat Dec 16 15:40:46 UTC 2023
PRIMARY
CAS
25120-99-4
Created by admin on Sat Dec 16 15:40:46 UTC 2023 , Edited by admin on Sat Dec 16 15:40:46 UTC 2023
PRIMARY
FDA UNII
KD92YL1IS2
Created by admin on Sat Dec 16 15:40:46 UTC 2023 , Edited by admin on Sat Dec 16 15:40:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP