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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H29BrO4
Molecular Weight 461.389
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMETHENMADINONE ACETATE

SMILES

CC(=O)O[C@]1(C(C)=O)C(=C)C[C@H]2[C@@H]3C=C(Br)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=GIUDLKYATCHBDT-USYNNDFZSA-N
InChI=1S/C24H29BrO4/c1-13-10-19-17-12-21(25)20-11-16(28)6-8-22(20,4)18(17)7-9-23(19,5)24(13,14(2)26)29-15(3)27/h11-12,17-19H,1,6-10H2,2-5H3/t17-,18+,19+,22-,23+,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H29BrO4
Molecular Weight 461.389
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 09:54:29 GMT 2025
Edited
by admin
on Wed Apr 02 09:54:29 GMT 2025
Record UNII
3Z2W46W5HS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-bromo-9a,11a-dimethyl-2-methylidene-7-oxo-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
Preferred Name English
BROMETHENMADINONE ACETATE
Common Name English
17.ALPHA.-ACETOXY-6-BROMO-16-METHYLENEPREGNA-4,6-DIENE-3,20-DIONE
Systematic Name English
PREGNA-4,6-DIENE-3,20-DIONE, 6-BROMO-17-HYDROXY-16-METHYLENE-, ACETATE
Systematic Name English
6-BROMO-16-METHYLENE-17.ALPHA.-HYDROXY-4,6-PREGNADIENE-3,20-DIONE 17-ACETATE
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Bromethenmadinone acetate
Created by admin on Wed Apr 02 09:54:29 GMT 2025 , Edited by admin on Wed Apr 02 09:54:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID001169304
Created by admin on Wed Apr 02 09:54:29 GMT 2025 , Edited by admin on Wed Apr 02 09:54:29 GMT 2025
PRIMARY
CAS
24431-75-2
Created by admin on Wed Apr 02 09:54:29 GMT 2025 , Edited by admin on Wed Apr 02 09:54:29 GMT 2025
PRIMARY
FDA UNII
3Z2W46W5HS
Created by admin on Wed Apr 02 09:54:29 GMT 2025 , Edited by admin on Wed Apr 02 09:54:29 GMT 2025
PRIMARY
PUBCHEM
90679394
Created by admin on Wed Apr 02 09:54:29 GMT 2025 , Edited by admin on Wed Apr 02 09:54:29 GMT 2025
PRIMARY
Related Record Type Details
ANALOGUE->TARGET
ANALOGUE->TARGET