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Details

Stereochemistry ACHIRAL
Molecular Formula C21H26O4
Molecular Weight 342.4287
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEOXYPREDNISOLONE-16-ENE

SMILES

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC=C2C(=O)CO

InChI

InChIKey=AXIAZKUMDZKRSI-SCVOTXIRSA-N
InChI=1S/C21H26O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h6-9,14-15,17,19,22,24H,3-5,10-11H2,1-2H3/t14-,15-,17-,19+,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H26O4
Molecular Weight 342.4287
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 Wed Apr 02 10:52:38 GMT 2025
Edited
by admin
on Wed Apr 02 10:52:38 GMT 2025
Record UNII
690A9G75VL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEOXYPREDNISOLONE-16-ENE [USP IMPURITY]
Preferred Name English
DEOXYPREDNISOLONE-16-ENE
Common Name English
11.BETA.,21-DIHYDROXYPREGNA-1,4,16-TRIENE-3,20-DIONE
Systematic Name English
(11.BETA.)-11,21-DIHYDROXYPREGNA-1,4,16-TRIENE-3,20-DIONE
Systematic Name English
PREGNA-1,4,16-TRIENE-3,20-DIONE, 11,21-DIHYDROXY-, (11.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
690A9G75VL
Created by admin on Wed Apr 02 10:52:38 GMT 2025 , Edited by admin on Wed Apr 02 10:52:38 GMT 2025
PRIMARY
CAS
3103-17-1
Created by admin on Wed Apr 02 10:52:38 GMT 2025 , Edited by admin on Wed Apr 02 10:52:38 GMT 2025
PRIMARY
PUBCHEM
14233399
Created by admin on Wed Apr 02 10:52:38 GMT 2025 , Edited by admin on Wed Apr 02 10:52:38 GMT 2025
PRIMARY
Related Record Type Details
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