SpectraBase Compound ID | Eo4iElsNB53 |
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InChI | InChI=1S/C27H43FO/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23H,6-14,16H2,1-5H3 |
InChIKey | JSNWCUZXBLJXQV-UHFFFAOYSA-N |
Mol Weight | 402.6 g/mol |
Molecular Formula | C27H43FO |
Exact Mass | 402.329794 g/mol |
SpectraBase Spectrum ID | 702c6UarQAm |
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Name | Cholest-4-en-6-one, 3.beta.-fluoro- |
Alternate Name(s) | 3-Fluorocholest-4-en-6-one 17-(1,5-dimethylhexyl)-3-fluoro-10,13-dimethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 3-Fluoranyl-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 3-Fluoro-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 3.beta.-Fluoro-6-oxo-4-cholestene |
CAS Registry Number | 31756-69-1 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H43FO |
InChI | InChI=1S/C27H43FO/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23H,6-14,16H2,1-5H3 |
InChIKey | JSNWCUZXBLJXQV-UHFFFAOYSA-N |
Molecular Weight | 402.638 g/mol |
SMILES | CC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CC(C2=CC(CC1)F)=O |
SPLASH | splash10-014i-3529200000-c7ad6b1c4b51e716191d |
Source of Spectrum | OS-5-241-0 |
Wiley ID | 1370641 |