Cholest-5-en-22-yn-20-ol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (3.beta.)-

SpectraBase Compound ID	1NPfpcVjgye
InChI	InChI=1S/C33H56O2Si/c1-23(2)12-11-19-33(8,34)29-16-15-27-26-14-13-24-22-25(35-36(9,10)30(3,4)5)17-20-31(24,6)28(26)18-21-32(27,29)7/h13,23,25-29,34H,12,14-18,20-22H2,1-10H3/t25-,26-,27-,28-,29-,31-,32-,33-/m0/s1
InChIKey	ZPHNHOCQKBLCNP-KGQPXBGFSA-N Google Search
Mol Weight	512.9 g/mol
Molecular Formula	C33H56O2Si
Exact Mass	512.404958 g/mol

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SpectraBase Spectrum ID	Ci8xmh0NNHX
Name	Cholest-5-en-22-yn-20-ol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (3.beta.)-
Alternate Name(s)	(3beta)-3-{[tert-butyl(dimethyl)silyl]oxy}cholest-5-en-22-yn-20-ol 3.beta.-t-butyldimethylsilyloxy-cholest-5-en-22-yn-20(R)-diol (2R)-2-[(3S,8S,9S,10R,13S,14S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-3-heptyn-2-ol (2R)-2-[(3S,8S,9S,10R,13S,14S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-3-yn-2-ol
CAS Registry Number	115910-64-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C33H56O2Si
InChI	InChI=1S/C33H56O2Si/c1-23(2)12-11-19-33(8,34)29-16-15-27-26-14-13-24-22-25(35-36(9,10)30(3,4)5)17-20-31(24,6)28(26)18-21-32(27,29)7/h13,23,25-29,34H,12,14-18,20-22H2,1-10H3/t25-,26-,27-,28-,29-,31-,32-,33-/m0/s1
InChIKey	ZPHNHOCQKBLCNP-KGQPXBGFSA-N
Molecular Weight	512.894 g/mol
SMILES	O[C@@](C#CCC(C)C)([C@@]1([C@@]2([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](O[Si](C(C)(C)C)(C)C)(C4)[H])C)[H])(CC1)[H])C)[H])C
SPLASH	splash10-0a4i-0001900000-4890014ae20f10a06e2a
Source of Spectrum	F-44-1148-14
Wiley ID	1400912