| SpectraBase Spectrum ID |
5CJhOmmDzCK |
| Name |
(1R,3E,7Z,11S)-17-Hydroxy-13-ketodolabella-3,7,12(18)-triene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O2 |
| InChI |
InChI=1S/C20H30O2/c1-14(2)19-17-9-8-16(13-21)7-5-6-15(3)10-11-20(17,4)12-18(19)22/h7,10,17,21H,5-6,8-9,11-13H2,1-4H3/b15-10+,16-7-/t17-,20-/m1/s1 |
| InChIKey |
XCWWROJTFHSKBO-ZTHPXSDRSA-N |
| Instrument Name |
Agilent 5977A MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.1c00199 |
| Molecular Weight |
302.458 g/mol |
| Optical Rotation |
[a]D23 = +6.6 (c = 0.04, CHCl3) |
| Reported Formula |
C20H31O2 |
| SMILES |
OC\C=1CC[C@]2([C@](C\C=C\(CCC\1)C)(CC(C2=C(C)C)=O)C)[H] |
| SPLASH |
splash10-0pxu-9700000000-b4709d9effa7a208738d |
| Source of Spectrum |
G4-84-1380-6 |
| Wiley ID |
1884151 |
