| SpectraBase Spectrum ID |
3zWEjSlmhYt |
| Name |
Cholestan-3-one, 25-hydroxy-, (5.beta.)- |
| Alternate Name(s) |
(5beta)-25-hydroxycholestan-3-one
25-Hydroxy-5.beta.-cholestan-3-one |
| CAS Registry Number |
76571-81-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O2 |
| InChI |
InChI=1S/C27H46O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h18-19,21-24,29H,6-17H2,1-5H3/t18-,19-,21+,22-,23+,24+,26+,27-/m1/s1 |
| InChIKey |
AFBVMKBXEPWMLL-PICCOZGHSA-N |
| Molecular Weight |
402.663 g/mol |
| SMILES |
OC(CCC[C@]([C@@]1([C@@]2([C@]([C@@]3(CC[C@]4([C@@]([C@]3(CC2)[H])(CCC(=O)C4)C)[H])[H])(CC1)[H])C)[H])(C)[H])(C)C |
| SPLASH |
splash10-0a4i-9013000000-9f7c8e6239e3b5756849 |
| Source of Spectrum |
KC-1989-468-11 |
| Wiley ID |
1370697 |
