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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H35BrN2O5
Molecular Weight 547.481
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Androstan-3-one, 17-(acetyloxy)-2-bromo-, O-(4-nitrophenyl)oxime, (2?,5?,17?)-

SMILES

CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C\C(=N/OC5=CC=C(C=C5)[N+]([O-])=O)[C@H](Br)C[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=RZOPFFIQLURKLI-JTSDWKJBSA-N
InChI=1S/C27H35BrN2O5/c1-16(31)34-25-11-10-21-20-9-4-17-14-24(29-35-19-7-5-18(6-8-19)30(32)33)23(28)15-27(17,3)22(20)12-13-26(21,25)2/h5-8,17,20-23,25H,4,9-15H2,1-3H3/b29-24+/t17-,20-,21-,22-,23+,25-,26-,27-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Androstan-3-one, 17-(acetyloxy)-2-bromo-, O-(4-nitrophenyl)oxime, (2?,5?,17?)-
Common Name English
5?-Androstan-3-one, 2?-bromo-17?-hydroxy-, O-(p-nitrophenyl)oxime, acetate (ester)
Preferred Name English
[(3E,5S,8R,9S,10S,13S,14S,17S)-2-Bromo-10,13-dimethyl-3-(4-nitrophenoxy)imino-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
172027080
Created by admin on Wed Apr 02 20:56:19 GMT 2025 , Edited by admin on Wed Apr 02 20:56:19 GMT 2025
PRIMARY
FDA UNII
7P688S7UGR
Created by admin on Wed Apr 02 20:56:19 GMT 2025 , Edited by admin on Wed Apr 02 20:56:19 GMT 2025
PRIMARY
CAS
33510-44-0
Created by admin on Wed Apr 02 20:56:19 GMT 2025 , Edited by admin on Wed Apr 02 20:56:19 GMT 2025
PRIMARY