(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(1R)-1-methyl-2-[(1S,3R)-2,2,3-tribromo-3-isopropyl-cyclopropyl]ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

SpectraBase Compound ID	BHCioLukfX1
InChI	InChI=1S/C28H43Br3O/c1-16(2)27(29)24(28(27,30)31)14-17(3)21-8-9-22-20-7-6-18-15-19(32)10-12-25(18,4)23(20)11-13-26(21,22)5/h6,16-17,19-24,32H,7-15H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,25+,26-,27-/m1/s1
InChIKey	CDCJNUMVEXTYKB-VOMDRDPDSA-N Google Search
Mol Weight	635.4 g/mol
Molecular Formula	C28H43Br3O
Exact Mass	632.086405 g/mol

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SpectraBase Spectrum ID	4pdDlgju5HX
Name	(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(1R)-1-methyl-2-[(1S,3R)-2,2,3-tribromo-3-isopropyl-cyclopropyl]ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C28H43Br3O
InChI	InChI=1S/C28H43Br3O/c1-16(2)27(29)24(28(27,30)31)14-17(3)21-8-9-22-20-7-6-18-15-19(32)10-12-25(18,4)23(20)11-13-26(21,22)5/h6,16-17,19-24,32H,7-15H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,25+,26-,27-/m1/s1
InChIKey	CDCJNUMVEXTYKB-VOMDRDPDSA-N
Molecular Weight	635.363 g/mol
SMILES	O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@@]([C@@](C[C@@]5(C([C@@]5(Br)C(C)C)(Br)Br)[H])(C)[H])(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C)[H]
SPLASH	splash10-01wr-0190032000-a5cf2d7a9dfeb38fb415
Source of Spectrum	K1-2000-1035-17
Synonyms	(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-1-[(1S,3R)-2,2,3-tribromo-3-propan-2-ylcyclopropyl]propan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-1-[(1S,3R)-2,2,3-tris(bromanyl)-3-propan-2-yl-cyclopropyl]propan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID	749899