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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H30ClFO4
Molecular Weight 448.955
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (17R)-4-CHLORO-5-ETHYL-9-FLUORO-11.BETA.-HYDROXY-16.BETA.-METHYLSPIRO(ANDROSTA-1,4-DIENE-17,2(3H)-FURAN)-3,3-DIONE

SMILES

CCC1=C(Cl)C(=O)[C@@]2(O1)[C@@H](C)C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]23C

InChI

InChIKey=LXZPFTQONPQBQD-TUZVJILZSA-N
InChI=1S/C25H30ClFO4/c1-5-18-20(26)21(30)25(31-18)13(2)10-17-16-7-6-14-11-15(28)8-9-22(14,3)24(16,27)19(29)12-23(17,25)4/h8-9,11,13,16-17,19,29H,5-7,10,12H2,1-4H3/t13-,16-,17-,19-,22-,23-,24-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H30ClFO4
Molecular Weight 448.955
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 Tue Apr 01 16:23:41 GMT 2025
Edited
by admin
on Tue Apr 01 16:23:41 GMT 2025
Record UNII
5VZH8T9KX7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(17R)-4-CHLORO-5-ETHYL-9-FLUORO-11.BETA.-HYDROXY-16.BETA.-METHYLSPIRO(ANDROSTA-1,4-DIENE-17,2(3H)-FURAN)-3,3-DIONE
Systematic Name English
CLOBETASOL PROPIONATE IMPURITY J [EP IMPURITY]
Preferred Name English
(2'R,8S,9R,10S,11S,13S,14S,16S)-4'-CHLORO-5'-ETHYL-9-FLUORO-11-HYDROXY-10,13,16-TRIMETHYL-7,8,9,10,11,12,13,14,15,16-DECAHYDRO-3'H-SPIRO(CYCLOPENTA(A)PHENANTHRENE-17,2'-FURAN)-3,3'(6H)-DIONE
Systematic Name English
Code System Code Type Description
CAS
1486466-31-2
Created by admin on Tue Apr 01 16:23:41 GMT 2025 , Edited by admin on Tue Apr 01 16:23:41 GMT 2025
PRIMARY
PUBCHEM
71312559
Created by admin on Tue Apr 01 16:23:41 GMT 2025 , Edited by admin on Tue Apr 01 16:23:41 GMT 2025
PRIMARY
FDA UNII
5VZH8T9KX7
Created by admin on Tue Apr 01 16:23:41 GMT 2025 , Edited by admin on Tue Apr 01 16:23:41 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP