SpectraBase Spectrum ID |
jJeJJrnAe |
Name |
Debilisone A |
Appearance |
White amorphous solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H40O3 |
InChI |
InChI=1S/C25H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-21-24(22-26)28-25(23)27/h23-24,26H,2-6,11-22H2,1H3/t23-,24-/m0/s1 |
InChIKey |
DOLRGEUCSXXZRK-ZEQRLZLVSA-N |
Instrument Name |
Varian CP-3800 GC 1200 L Quadrupole |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np1001913 |
Molecular Weight |
388.592 g/mol |
Optical Rotation |
[a]D23 = +22.0 (c = 0.206, CHCl3) |
Reported Formula |
C25H40O3 |
SMILES |
OC[C@]1(OC([C@](C1)(CCCCCCCCCCC#CC#CCCCCCC)[H])=O)[H] |
SPLASH |
splash10-052f-9300000000-2c801f730994680274be |
Source of Spectrum |
G4-73-SM4-1 |
Wiley ID |
1849001 |