Cholest-5-ene-3,19-diol, 3-acetate, (3.beta.)-

SpectraBase Compound ID	1QePgAOMDUw
InChI	InChI=1S/C29H48O3/c1-19(2)7-6-8-20(3)25-11-12-26-24-10-9-22-17-23(32-21(4)31)13-16-29(22,18-30)27(24)14-15-28(25,26)5/h9,19-20,23-27,30H,6-8,10-18H2,1-5H3
InChIKey	ZUYKAEVLUWUNMD-UHFFFAOYSA-N Google Search
Mol Weight	444.7 g/mol
Molecular Formula	C29H48O3
Exact Mass	444.360345 g/mol

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SpectraBase Spectrum ID	5VvSWbxVrB0
Name	Cholest-5-ene-3,19-diol, 3-acetate, (3.beta.)-
CAS Registry Number	750-59-4
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H48O3
InChI	InChI=1S/C29H48O3/c1-19(2)7-6-8-20(3)25-11-12-26-24-10-9-22-17-23(32-21(4)31)13-16-29(22,18-30)27(24)14-15-28(25,26)5/h9,19-20,23-27,30H,6-8,10-18H2,1-5H3
InChIKey	ZUYKAEVLUWUNMD-UHFFFAOYSA-N
Molecular Weight	444.700 g/mol
SMILES	OCC12C3C(C4C(C)(C(C(CCCC(C)C)C)CC4)CC3)CC=C1CC(OC(C)=O)CC2
SPLASH	splash10-0udi-0169000000-445ed8e4ea83ebb85d30
Source of Spectrum	T-68-5507-0
Synonyms	19-Hydroxycholest-5-en-3-yl acetate 19-Hydroxycholesterol 3-acetate 19-Hydroxycholesteryl acetate Cholest-5-ene-3.beta.,19-diol, 3-acetate Acetic acid [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate NSC 123342
Wiley ID	1386161