SpectraBase Spectrum ID |
6RnwwdcGDCo |
Name |
2,2-Dimethyl-5.beta.-cholestan-3-ol |
CAS Registry Number |
113725-49-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H52O |
InChI |
InChI=1S/C29H52O/c1-19(2)9-8-10-20(3)23-13-14-24-22-12-11-21-17-26(30)27(4,5)18-29(21,7)25(22)15-16-28(23,24)6/h19-26,30H,8-18H2,1-7H3/t20-,21-,22+,23-,24+,25+,26?,28-,29+/m1/s1 |
InChIKey |
XQQUUPKFCOSGLB-ZBCVPHANSA-N |
Molecular Weight |
416.734 g/mol |
SMILES |
OC1C[C@@]2([C@@]([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC2)[H])(CC1(C)C)C)[H] |
SPLASH |
splash10-002b-0019000000-eaa4032c7e81d996abb4 |
Source of Spectrum |
AJ-60-1081-32 |
Synonyms |
(5beta)-2,2-dimethylcholestan-3-ol |
Wiley ID |
1376716 |