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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H28Cl2O4
Molecular Weight 439.372
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17-(ACETYLOXY)-4,6-DICHLOROPREGNA-4,6-DIENE-3,20-DIONE

SMILES

CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=C(Cl)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O

InChI

InChIKey=OBYHDLYSXGXEMJ-OTQPZKAKSA-N
InChI=1S/C23H28Cl2O4/c1-12(26)23(29-13(2)27)10-6-16-14-11-17(24)19-20(25)18(28)7-8-21(19,3)15(14)5-9-22(16,23)4/h11,14-16H,5-10H2,1-4H3/t14-,15+,16+,21-,22+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H28Cl2O4
Molecular Weight 439.372
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:26:08 GMT 2025
Edited
by admin
on Mon Mar 31 21:26:08 GMT 2025
Record UNII
33J0LYD8E7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
17-(ACETYLOXY)-4,6-DICHLOROPREGNA-4,6-DIENE-3,20-DIONE
Systematic Name English
PREGNA-4,6-DIENE-3,20-DIONE, 4,6-DICHLORO-17-HYDROXY-, ACETATE
Preferred Name English
PREGNA-4,6-DIENE-3,20-DIONE, 17-(ACETYLOXY)-4,6-DICHLORO-
Systematic Name English
Code System Code Type Description
FDA UNII
33J0LYD8E7
Created by admin on Mon Mar 31 21:26:08 GMT 2025 , Edited by admin on Mon Mar 31 21:26:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID20274882
Created by admin on Mon Mar 31 21:26:08 GMT 2025 , Edited by admin on Mon Mar 31 21:26:08 GMT 2025
PRIMARY
CAS
19892-45-6
Created by admin on Mon Mar 31 21:26:08 GMT 2025 , Edited by admin on Mon Mar 31 21:26:08 GMT 2025
PRIMARY
PUBCHEM
23619609
Created by admin on Mon Mar 31 21:26:08 GMT 2025 , Edited by admin on Mon Mar 31 21:26:08 GMT 2025
PRIMARY