SpectraBase Spectrum ID |
KJvDtp8FcPU |
Name |
(22S,24S)-3.beta.-Acetoxy-22-hydroxy-24-methyl-5.alpha.-cholestan-6-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H50O4 |
InChI |
InChI=1S/C30H50O4/c1-17(2)18(3)14-27(32)19(4)23-8-9-24-22-16-28(33)26-15-21(34-20(5)31)10-12-30(26,7)25(22)11-13-29(23,24)6/h17-19,21-27,32H,8-16H2,1-7H3/t18-,19-,21-,22-,23+,24-,25-,26+,27-,29+,30+/m0/s1 |
InChIKey |
RXJIBMCVHIKTDO-RNEZWAKFSA-N |
Molecular Weight |
474.726 g/mol |
SMILES |
O[C@]([C@]([C@@]1([C@]2(CC[C@]3([C@@]([C@@]2(CC1)[H])([H])CC([C@@]1([C@@]3(CC[C@](OC(=O)C)(C1)[H])C)[H])=O)[H])C)[H])(C)[H])(C[C@@](C(C)C)(C)[H])[H] |
SPLASH |
splash10-0udi-0009000000-0964721994fcf8961334 |
Source of Spectrum |
F-53-17052-19 |
Synonyms |
(3beta,5alpha,22S)-22-hydroxy-6-oxoergostan-3-yl acetate |
Wiley ID |
804717 |