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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H26O4
Molecular Weight 366.4501
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,20-Dioxopregna-1,4,9(11),16-tetraen-21-yl acetate

SMILES

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C

InChI

InChIKey=UFEOMHFPJREVTP-PTRHGPIFSA-N
InChI=1S/C23H26O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h7-10,12,17-18H,4-6,11,13H2,1-3H3/t17-,18-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
3,20-Dioxopregna-1,4,9(11),16-tetraen-21-yl acetate
Systematic Name English
21-HYDROXYPREGNA-1,4,9(11),16-TETRAENE-3,20-DIONE 21-ACETATE
Preferred Name English
2-((10S,13S,14S)-10,13-Dimethyl-3-oxo-6,7,8,10,12,13,14,15-octahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate
Systematic Name English
21-Acetoxypregna-1,4,9(11),16-tetraene-3,20-dione
Systematic Name English
21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione
Systematic Name English
3TR
Common Name English
21-Hydroxy-1,4,9(11)-tetraene 21-acetate
Systematic Name English
Pregna-1,4,9(11),16-tetraene-3,20-dione, 21-(acetyloxy)-
Systematic Name English
Code System Code Type Description
FDA UNII
TZY8B5Z4UB
Created by admin on Tue Apr 01 19:24:51 GMT 2025 , Edited by admin on Tue Apr 01 19:24:51 GMT 2025
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EPA CompTox
DTXSID60190855
Created by admin on Tue Apr 01 19:24:51 GMT 2025 , Edited by admin on Tue Apr 01 19:24:51 GMT 2025
PRIMARY
CAS
37413-91-5
Created by admin on Tue Apr 01 19:24:51 GMT 2025 , Edited by admin on Tue Apr 01 19:24:51 GMT 2025
PRIMARY
PUBCHEM
10926647
Created by admin on Tue Apr 01 19:24:51 GMT 2025 , Edited by admin on Tue Apr 01 19:24:51 GMT 2025
PRIMARY
ECHA (EC/EINECS)
253-497-3
Created by admin on Tue Apr 01 19:24:51 GMT 2025 , Edited by admin on Tue Apr 01 19:24:51 GMT 2025
PRIMARY