SpectraBase Compound ID | 4JfIAibOuqJ |
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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/h10,18-20,24-27H,7-9,11-17H2,1-6H3 |
InChIKey | DGCXQKBLGRZRTK-UHFFFAOYSA-N |
Mol Weight | 426.7 g/mol |
Molecular Formula | C29H46O2 |
Exact Mass | 426.349781 g/mol |
SpectraBase Spectrum ID | 8SaEjfgHiPg |
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Name | Cholesta-3,5-dien-3-yl acetate |
CAS Registry Number | 2309-32-2 |
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/h10,18-20,24-27H,7-9,11-17H2,1-6H3 |
InChIKey | DGCXQKBLGRZRTK-UHFFFAOYSA-N |
Molecular Weight | 426.685 g/mol |
SMILES | CC12C3C(C4C(C)(C(C(CCCC(C)C)C)CC4)CC3)CC=C1C=C(CC2)OC(C)=O |
SPLASH | splash10-003r-2109400000-d62f102c52961de369f5 |
Source of Spectrum | SD-1981-0-0 |
Synonyms | 3-Acetoxycholesta-3,5-diene Cholest-3,5-diene-3.beta.-ol acetate Acetic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
Wiley ID | 1380130 |