SpectraBase Spectrum ID |
I5PKo4Nf8d2 |
Name |
C(14A)-Homo-27-nor-14.beta.-gammaceran-3.alpha.-ol |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
428.401816293 u |
Formula |
C30H52O |
InChI |
InChI=1S/C30H52O/c1-26(2)15-8-16-29(6)21-10-12-24-28(5,19-20(21)9-11-22(26)29)17-13-23-27(3,4)25(31)14-18-30(23,24)7/h20-25,31H,8-19H2,1-7H3 |
InChIKey |
GAPITCNXWSCZLW-UHFFFAOYSA-N |
Molecular Weight |
428.745 g/mol |
SMILES |
CC12C3C(C)(CC4CCC5C(C4CC3)(C)CCCC5(C)C)CCC1C(C)(C)C(CC2)O |