| SpectraBase Spectrum ID |
LCdERgCxOrT |
| Name |
(1R,3S,4S,5S,10R,11R)-1-Acetyloxy-7-oxolongipin-8-ene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24O3 |
| InChI |
InChI=1S/C17H24O3/c1-9-8-11(20-10(2)18)14-15-13(9)17(14,5)7-6-12(19)16(15,3)4/h6-7,9,11,13-15H,8H2,1-5H3/t9-,11+,13-,14+,15-,17+/m0/s1 |
| InChIKey |
QQRMQBQGEXEGOF-DOKZUKNISA-N |
| Instrument Name |
Hewlett-Packard 5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020158s |
| Molecular Weight |
276.376 g/mol |
| Optical Rotation |
[a]D = +72 (589 nm), +76 (578 nm), +90 (546 nm), +206 (436 nm), +555 (365 nm) (c = 0.18, CHCl3) |
| Reported Formula |
C17H24O3 |
| SMILES |
C1[C@]([C@@]2([C@@]3([C@]([C@]1(C)[H])([C@]2(C=CC(C3(C)C)=O)C)[H])[H])[H])(OC(C)=O)[H] |
| SPLASH |
splash10-0002-2900000000-bc95b4a3e9ee82bba1b2 |
| Source of Spectrum |
G4-65-1408-6 |
| Wiley ID |
1883402 |
