| SpectraBase Spectrum ID |
L4AgGa54QiK |
| Name |
5,6.alpha.-Epoxy-5.alpha.-cholestan-3.alpha.-ol |
| Alternate Name(s) |
(3R,4aS,5aS,6aS,6bS,9R,9aR,11aS,11bR)-9-[(1R)-1,5-dimethylhexyl]-9a,11b-dimethylhexadecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-3-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O2 |
| InChI |
InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19-,20+,21-,22+,23+,24+,25-,26-,27-/m1/s1 |
| InChIKey |
PRYIJAGAEJZDBO-FRYLZWIASA-N |
| Molecular Weight |
402.663 g/mol |
| SMILES |
O[C@]1(C[C@]23O[C@]3(C[C@@]3([C@@]([C@]2(CC1)C)(CC[C@@]1([C@@]([C@@](CCCC(C)C)(C)[H])(CC[C@@]31[H])[H])C)[H])[H])[H])[H] |
| SPLASH |
splash10-0udi-0004900000-a89120ca014b27bfd5ce |
| Source of Spectrum |
PS-50-1842-15 |
| Wiley ID |
1370706 |
