| SpectraBase Spectrum ID |
GApOLxa8iSf |
| Name |
(22R,23R,24R)-3.beta.-Acetoxy-22-bromo-23-hydroxy-24-methyl-5.alpha.-cholestan-6-one |
| Alternate Name(s) |
(3beta,5alpha,22R,23R)-22-bromo-23-hydroxy-6-oxoergostan-3-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H49BrO4 |
| InChI |
InChI=1S/C30H49BrO4/c1-16(2)17(3)28(34)27(31)18(4)22-8-9-23-21-15-26(33)25-14-20(35-19(5)32)10-12-30(25,7)24(21)11-13-29(22,23)6/h16-18,20-25,27-28,34H,8-15H2,1-7H3/t17-,18+,20+,21+,22-,23+,24+,25-,27-,28-,29-,30-/m1/s1 |
| InChIKey |
PQEICXDUWAOGET-SQRXJRJYSA-N |
| Molecular Weight |
553.622 g/mol |
| SMILES |
O[C@@]([C@@]([C@]([C@]1(CC[C@]2([C@@]3(CC([C@]4(C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(OC(=O)C)[H])[H])=O)[H])[H])[H])(C)[H])(Br)[H])([C@@](C(C)C)(C)[H])[H] |
| SPLASH |
splash10-0006-9000400000-9550fabce02d4512579d |
| Source of Spectrum |
F-53-17049-7 |
| Wiley ID |
804728 |
