| SpectraBase Spectrum ID |
4bwq4DUDU9L |
| Name |
(3.beta.,20(22)E,23Z)-24-(Methylthio)-3-[(tetrahydro-2H-pyran-2-yl)oxy]cholesta-5,20(22),23-trien-25-ol |
| CAS Registry Number |
84051-41-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H52O3S |
| InChI |
InChI=1S/C33H52O3S/c1-22(10-15-29(37-6)31(2,3)34)26-13-14-27-25-12-11-23-21-24(36-30-9-7-8-20-35-30)16-18-32(23,4)28(25)17-19-33(26,27)5/h10-11,15,24-28,30,34H,7-9,12-14,16-21H2,1-6H3/b22-10-,29-15-/t24-,25-,26+,27-,28-,30?,32-,33+/m0/s1 |
| InChIKey |
LNWNBVYODIBFPQ-AFWUAHHESA-N |
| Molecular Weight |
528.836 g/mol |
| SMILES |
OC(\C(=C\C=C/([C@@]1([C@@]2([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC2OCCCC2)(C4)[H])C)[H])(CC1)[H])C)[H])C)SC)(C)C |
| SPLASH |
splash10-002r-9000070000-0f8673588d763ba3849f |
| Source of Spectrum |
J-49-1088-0 |
| Synonyms |
(3beta,20Z,23Z)-24-(methylsulfanyl)-3-(tetrahydro-2H-pyran-2-yloxy)cholesta-5,20(22),23-trien-25-ol |
| Wiley ID |
1403126 |
![(3.beta.,20(22)E,23Z)-24-(Methylthio)-3-[(tetrahydro-2H-pyran-2-yl)oxy]cholesta-5,20(22),23-trien-25-ol](/api/spectrum/4bwq4DUDU9L/structure.png?h=300&w=458 "(3.beta.,20(22)E,23Z)-24-(Methylthio)-3-[(tetrahydro-2H-pyran-2-yl)oxy]cholesta-5,20(22),23-trien-25-ol")
