| SpectraBase Spectrum ID |
5rBRQTaajsA |
| Name |
(1S,3R,4S,5S,6S,9R,10R,11R)-13-Acetoxy-9,11-epoxyjiquilpane |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H26O3 |
| InChI |
InChI=1S/C17H26O3/c1-9-7-11-15-14-13(9)17(11,4)12(20-15)5-6-16(14,3)8-19-10(2)18/h9,11-15H,5-8H2,1-4H3/t9-,11-,12-,13+,14+,15+,16-,17-/m1/s1 |
| InChIKey |
LATQJEITUQIHPS-DMAOTTOMSA-N |
| Instrument Name |
Varian Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.0c01160 |
| Molecular Weight |
278.392 g/mol |
| Optical Rotation |
[a] = -94 (589 nm), -99 (578 nm), -112 (546 nm), -192 (436 nm), -308 (365 nm) (c = 0.5, CHCl3) |
| Reported Formula |
C17H26O3 |
| SMILES |
[C@@]1(C[C@]2([C@]3([C@@]1([C@]1([C@]2(O[C@@]3(CC[C@]1(C)COC(C)=O)[H])[H])[H])[H])C)[H])(C)[H] |
| SPLASH |
splash10-014u-3690000000-d67b0adb99f7f8891f51 |
| Source of Spectrum |
G4-84-1093-6 |
| Wiley ID |
1884139 |
