| SpectraBase Spectrum ID |
7AbDj32OPjH |
| Name |
Cholan-12-one, (5.alpha.,20S)- |
| Alternate Name(s) |
(5alpha,20S)-cholan-12-one
20S-epimer of 5.alpha.-cholan-12-one |
| CAS Registry Number |
86708-93-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H40O |
| InChI |
InChI=1S/C24H40O/c1-5-8-16(2)19-12-13-20-18-11-10-17-9-6-7-14-23(17,3)21(18)15-22(25)24(19,20)4/h16-21H,5-15H2,1-4H3/t16-,17+,18-,19+,20-,21-,23-,24+/m0/s1 |
| InChIKey |
IBFJWYGUQHFWFX-GLRRTJSDSA-N |
| Molecular Weight |
344.583 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@]([C@]3(CC2=O)[H])(C)CCCC4)[H])[H])(CC[C@@]1([C@](CCC)(C)[H])[H])[H])C |
| SPLASH |
splash10-001l-5298000000-1ff50c59bc47fc49932b |
| Source of Spectrum |
AN-92-161-0 |
| Wiley ID |
1338408 |
