| SpectraBase Compound ID | 3D9VBq56NJe |
|---|---|
| InChI | InChI=1S/C28H48O2/c1-18(2)8-7-9-19(3)22-10-11-23-21-17-26(29)25-16-20(30-6)12-14-28(25,5)24(21)13-15-27(22,23)4/h18-25H,7-17H2,1-6H3 |
| InChIKey | GGNMCEMUZBBANL-UHFFFAOYSA-N |
| Mol Weight | 416.7 g/mol |
| Molecular Formula | C28H48O2 |
| Exact Mass | 416.365431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EenaMNKlRMY |
|---|---|
| Name | 5.alpha.-Cholestan-6-one, 3.beta.-methoxy- |
| CAS Registry Number | 5837-39-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H48O2 |
| InChI | InChI=1S/C28H48O2/c1-18(2)8-7-9-19(3)22-10-11-23-21-17-26(29)25-16-20(30-6)12-14-28(25,5)24(21)13-15-27(22,23)4/h18-25H,7-17H2,1-6H3 |
| InChIKey | GGNMCEMUZBBANL-UHFFFAOYSA-N |
| Molecular Weight | 416.690 g/mol |
| SMILES | CC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CC(C2CC(CC1)OC)=O |
| SPLASH | splash10-06r7-9100000000-63262318f37282eaca21 |
| Source of Spectrum | W5-34309-31227-31227 |
| Synonyms | 3-Methoxycholestan-6-one Cholestan-6-one, 3-methoxy-, (3.beta.,5.alpha.)- 17-(1,5-dimethylhexyl)-3-methoxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one 5.alpha.-Cholestan-6-one, 3.alpha.-methoxy- 3-Methoxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one 3.beta.-Methoxy-5.alpha.-cholesten-6-one |
| Wiley ID | 1376666 |