SpectraBase Spectrum ID |
HgQaE5a9seW |
Name |
(S)N,N-Diallyl-17,17-(ethylenedioxy)-estra-1,3,5(10)-triene-3-(difluoromethane)sulfonamide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H35F2NO4S |
InChI |
InChI=1S/C27H35F2NO4S/c1-4-14-30(15-5-2)35(31,32)27(28,29)20-7-9-21-19(18-20)6-8-23-22(21)10-12-25(3)24(23)11-13-26(25)33-16-17-34-26/h4-5,7,9,18,22-24H,1-2,6,8,10-17H2,3H3/t22?,23?,24?,25-/m0/s1 |
InChIKey |
JFLCDFMWYDYDQC-DGGBHQDZSA-N |
Molecular Weight |
507.637 g/mol |
SMILES |
C(S(N(CC=C)CC=C)(=O)=O)(c1cc2c(C3CC[C@]4(C(C3CC2)CCC42OCCO2)C)cc1)(F)F |
SPLASH |
splash10-0002-3009000000-2e221a012b84459713d1 |
Source of Spectrum |
F5-3-3333-16 |
Synonyms |
N,N-Diallyl-17,17-(ethylenedioxy)-estra-1,3,5(10)-triene-3-(difluoromethane)sulfonamide
N,N-diallyl-1,1-difluoro-1-((13S)-13-methyl-6,7,8,9,11,12,13,14,15,16-decahydrospiro[cyclopenta[a]phenanthrene-17,2'-[1,3]dioxolan]-3-yl)methanesulfonamide |
Wiley ID |
1732465 |