Cholesta-5,7-dien-3-ol, acetate, (3.beta.)-

SpectraBase Compound ID	Ipo1YolBJtx
InChI	InChI=1S/C29H46O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3
InChIKey	ACGNVBRAISEVDK-UHFFFAOYSA-N Google Search
Mol Weight	426.7 g/mol
Molecular Formula	C29H46O2
Exact Mass	426.349781 g/mol

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SpectraBase Spectrum ID	BW0TrXYVjUw
Name	Cholesta-5,7-dien-3-ol, acetate, (3.beta.)-
CAS Registry Number	1059-86-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H46O2
InChI	InChI=1S/C29H46O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3
InChIKey	ACGNVBRAISEVDK-UHFFFAOYSA-N
Molecular Weight	426.685 g/mol
SMILES	CC12C3C(C4C(C)(C(C(CCCC(C)C)C)CC4)CC3)=CC=C1CC(OC(C)=O)CC2
SPLASH	splash10-052f-6912000000-12e592c790804c5be375
Source of Spectrum	T-67-4838-0
Synonyms	3.beta.-Acetoxychoesta-5,7-diene 7-Dehydrocholesterol acetate 7-Dehydrocholesteryl acetate Cholest-5,7-dien-3.beta.-yl acetate Cholesta-5,7-dien-3-ol, acetate, (3beta)- Cholesta-5,7-dien-3.beta.-ol, acetate Cholesta-5,7-dien-3.beta.-yl acetate Acetic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate BRN 3224391 EINECS 213-896-5 NSC 226869
Wiley ID	59143