| SpectraBase Spectrum ID |
keL4PhsON8 |
| Name |
(20S,22S)-3.beta.,16.beta.-Dibutyryloxycholestane-20,22-diol |
| Alternate Name(s) |
(3beta,16beta,20S,22S)-16-(butyryloxy)-20,22-dihydroxycholestan-3-yl butyrate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H60O6 |
| InChI |
InChI=1S/C35H60O6/c1-8-10-30(37)40-24-16-18-33(5)23(20-24)13-14-25-26(33)17-19-34(6)27(25)21-28(41-31(38)11-9-2)32(34)35(7,39)29(36)15-12-22(3)4/h22-29,32,36,39H,8-21H2,1-7H3/t23?,24-,25+,26-,27-,28-,29-,32-,33-,34-,35+/m0/s1 |
| InChIKey |
FLXFWLZBHOFCFB-KXBMMLOGSA-N |
| Molecular Weight |
576.859 g/mol |
| SMILES |
O[C@]([C@@]([C@]1([C@](C[C@]2([C@@]3(CCC4C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(OC(=O)CCC)[H])[H])[H])(OC(=O)CCC)[H])[H])(C)O)(CCC(C)C)[H] |
| SPLASH |
splash10-0abd-0097360000-cec45a9f41518e01ca4a |
| Source of Spectrum |
J-67-2719-13 |
| Wiley ID |
1569492 |
