(3S,4S,5R,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-4-fluoro-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

SpectraBase Compound ID	3MeNFI7MjHL
InChI	InChI=1S/C27H47FO/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(28)24(29)14-16-27(23,5)22(19)13-15-26(20,21)4/h17-25,29H,6-16H2,1-5H3/t18-,19+,20-,21+,22+,23+,24+,25+,26-,27-/m1/s1
InChIKey	DVIRBCDIDKGGLB-ZXQYGXPFSA-N Google Search
Mol Weight	406.7 g/mol
Molecular Formula	C27H47FO
Exact Mass	406.361094 g/mol

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SpectraBase Spectrum ID	6qBVYFCvPdl
Name	(3S,4S,5R,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-4-fluoro-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H47FO
InChI	InChI=1S/C27H47FO/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(28)24(29)14-16-27(23,5)22(19)13-15-26(20,21)4/h17-25,29H,6-16H2,1-5H3/t18-,19+,20-,21+,22+,23+,24+,25+,26-,27-/m1/s1
InChIKey	DVIRBCDIDKGGLB-ZXQYGXPFSA-N
Molecular Weight	406.670 g/mol
SMILES	O[C@]1(CC[C@]2([C@]([C@@]1(F)[H])(CC[C@]1([C@@]3(CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])[H])[H])C)[H]
SPLASH	splash10-0udi-0091300000-3a63a6a32b491f626314
Source of Spectrum	K1-0-3699-14
Synonyms	(3S,4S,5R,8S,9S,10R,13R,14S,17R)-4-fluoranyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,4S,5R,8S,9S,10R,13R,14S,17R)-4-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID	1589273