| SpectraBase Spectrum ID |
FT5E3BQWxJ6 |
| Name |
Cholestan-4-one, 5-hydroxy-, (5.beta.)- |
| Alternate Name(s) |
(5beta)-5-hydroxycholestan-4-one
4-Oxo-5.beta.-cholestan-5-ol
5.beta.-cholestan-4-one, 5-hydroxy- |
| CAS Registry Number |
15222-86-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O2 |
| InChI |
InChI=1S/C27H46O2/c1-18(2)8-6-9-19(3)21-11-12-22-20-13-17-27(29)24(28)10-7-15-26(27,5)23(20)14-16-25(21,22)4/h18-23,29H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,25-,26-,27+/m1/s1 |
| InChIKey |
KTMRGGHFNOAMRH-RJGGPJCOSA-N |
| Molecular Weight |
402.663 g/mol |
| SMILES |
O[C@]12[C@@]([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCCC1=O)C |
| SPLASH |
splash10-053r-0009000000-f9e53ddbace9265c5cdd |
| Source of Spectrum |
KC-1982-927-0 |
| Wiley ID |
1370682 |
