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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H28O5
Molecular Weight 384.4654
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (11?)-21-(Acetyloxy)-11-hydroxypregna-1,4,16-triene-3,20-dione

SMILES

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C

InChI

InChIKey=ABGUZAVIFZZDDZ-MHYQPVDNSA-N
InChI=1S/C23H28O5/c1-13(24)28-12-20(27)18-7-6-17-16-5-4-14-10-15(25)8-9-22(14,2)21(16)19(26)11-23(17,18)3/h7-10,16-17,19,21,26H,4-6,11-12H2,1-3H3/t16-,17-,19-,21+,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
[2-[(8s,9s,10r,11s,13s,14s)-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Preferred Name English
(11?)-21-(Acetyloxy)-11-hydroxypregna-1,4,16-triene-3,20-dione
Systematic Name English
11?,21-Dihydroxypregna-1,4,16-triene-3,20-dione 21-acetate
Systematic Name English
Code System Code Type Description
FDA UNII
SKC3ME9NRE
Created by admin on Wed Apr 02 20:31:46 GMT 2025 , Edited by admin on Wed Apr 02 20:31:46 GMT 2025
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PUBCHEM
102365
Created by admin on Wed Apr 02 20:31:46 GMT 2025 , Edited by admin on Wed Apr 02 20:31:46 GMT 2025
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EPA CompTox
DTXSID20952779
Created by admin on Wed Apr 02 20:31:46 GMT 2025 , Edited by admin on Wed Apr 02 20:31:46 GMT 2025
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CAS
3044-42-6
Created by admin on Wed Apr 02 20:31:46 GMT 2025 , Edited by admin on Wed Apr 02 20:31:46 GMT 2025
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