U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H28O6
Molecular Weight 400.4648
Optical Activity ( + )
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Prednisone 17-acetate

SMILES

[H][C@@]12CC[C@](OC(C)=O)(C(=O)CO)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=PCDMOOFTYPHGTF-RFZYENFJSA-N
InChI=1S/C23H28O6/c1-13(25)29-23(19(28)12-24)9-7-17-16-5-4-14-10-15(26)6-8-21(14,2)20(16)18(27)11-22(17,23)3/h6,8,10,16-17,20,24H,4-5,7,9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Prednisone 17-acetate
Common Name English
Pregna-1,4-diene-3,11,20-trione, 17-(acetyloxy)-21-hydroxy-
Systematic Name English
17-(Acetyloxy)-21-hydroxypregna-1,4-diene-3,11,20-trione
Systematic Name English
Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxy-, 17-acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
22795023
Created by admin on Sat Dec 16 19:47:30 GMT 2023 , Edited by admin on Sat Dec 16 19:47:30 GMT 2023
PRIMARY
FDA UNII
V75YG9SRW9
Created by admin on Sat Dec 16 19:47:30 GMT 2023 , Edited by admin on Sat Dec 16 19:47:30 GMT 2023
PRIMARY
CAS
95440-71-4
Created by admin on Sat Dec 16 19:47:30 GMT 2023 , Edited by admin on Sat Dec 16 19:47:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID80875450
Created by admin on Sat Dec 16 19:47:30 GMT 2023 , Edited by admin on Sat Dec 16 19:47:30 GMT 2023
PRIMARY