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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H29BrO6
Molecular Weight 481.377
Optical Activity ( + )
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9α-Bromo prednisolone acetate

SMILES

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

InChI

InChIKey=URVOXDFUUFMHBL-GSLJADNHSA-N
InChI=1S/C23H29BrO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h6,8,10,16-18,27,29H,4-5,7,9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
9α-Bromo prednisolone acetate
Common Name English
Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-9-bromo-11,17-dihydroxy-, (11β)-
Systematic Name English
Pregna-1,4-diene-3,20-dione, 9-bromo-11β,17,21-trihydroxy-, 21-acetate
Systematic Name English
(11β)-21-(Acetyloxy)-9-bromo-11,17-dihydroxypregna-1,4-diene-3,20-dione
Systematic Name English
Code System Code Type Description
CAS
4224-31-1
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY
FDA UNII
LG4XX6T5EH
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY
PUBCHEM
13313389
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY