SpectraBase Spectrum ID |
5KHKl2C0zGT |
Name |
4a-oxa-4-hydroxy-A-homo-5.alpha.-cholestane |
CAS Registry Number |
93789-75-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H48O2 |
InChI |
InChI=1S/C27H48O2/c1-18(2)8-6-9-19(3)21-12-13-22-20-11-14-24-27(5,16-7-10-25(28)29-24)23(20)15-17-26(21,22)4/h18-25,28H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24-,25?,26-,27-/m1/s1 |
InChIKey |
APCUUFIHLWEDSN-DNJJGZIHSA-N |
Molecular Weight |
404.679 g/mol |
SMILES |
OC1O[C@]2([C@@]([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCC1)C)[H] |
SPLASH |
splash10-053r-9004000000-a0f4c7bea9cc7b7d3e1e |
Source of Spectrum |
J-50-2492-27 |
Synonyms |
(5aR,5bS,7aR,8R,10aS,10bS,12aR)-8-[(1R)-1,5-dimethylhexyl]-5a,7a-dimethylhexadecahydro-2H-cyclopenta[5,6]naphtho[2,1-b]oxepin-2-ol |
Wiley ID |
1371586 |