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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H35F2NO6S
Molecular Weight 539.632
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17?-[(N,N-Dimethylcarbamoyl)thio]carbonyl-6?,9?-difluoro-11?-hydroxy-16?-methyl-3-oxo-17?-(propionyloxy)androsta-1,4-diene

SMILES

CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)SC(=O)N(C)C

InChI

InChIKey=NQWYRNSFHOLIDB-OJAGFMMFSA-N
InChI=1S/C27H35F2NO6S/c1-7-21(33)36-27(22(34)37-23(35)30(5)6)14(2)10-16-17-12-19(28)18-11-15(31)8-9-24(18,3)26(17,29)20(32)13-25(16,27)4/h8-9,11,14,16-17,19-20,32H,7,10,12-13H2,1-6H3/t14-,16+,17+,19+,20+,24+,25+,26+,27+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Androsta-1,4-diene-17-carbothioic acid, 6,9-difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-, anhydrosulfide with N,N-dimethylcarbamothioic acid, (6?,11?,16?,17?)-
Preferred Name English
17?-[(N,N-Dimethylcarbamoyl)thio]carbonyl-6?,9?-difluoro-11?-hydroxy-16?-methyl-3-oxo-17?-(propionyloxy)androsta-1,4-diene
Systematic Name English
[(6S,8S,9R,10S,11S,13S,14S,16R,17R)-17-(Dimethylcarbamoylsulfanylcarbonyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
Systematic Name English
Code System Code Type Description
FDA UNII
VN36WT4HST
Created by admin on Wed Apr 02 20:24:01 GMT 2025 , Edited by admin on Wed Apr 02 20:24:01 GMT 2025
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PUBCHEM
11432665
Created by admin on Wed Apr 02 20:24:01 GMT 2025 , Edited by admin on Wed Apr 02 20:24:01 GMT 2025
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CAS
105638-31-1
Created by admin on Wed Apr 02 20:24:01 GMT 2025 , Edited by admin on Wed Apr 02 20:24:01 GMT 2025
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