| SpectraBase Spectrum ID |
KdZhUyLfnNn |
| Name |
(3R,4S,5S,6S,9R,10R,11R)-9,13-Diacetoxylongipinan-1-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H28O5 |
| InChI |
InChI=1S/C19H28O5/c1-10-8-13(22)16-17-15(10)19(16,5)14(24-12(3)21)6-7-18(17,4)9-23-11(2)20/h10,14-17H,6-9H2,1-5H3/t10-,14-,15+,16-,17+,18-,19-/m1/s1 |
| InChIKey |
IBLBFBLQNBITRR-XRUWMMDGSA-N |
| Instrument Name |
Varian Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.0c01160 |
| Molecular Weight |
336.428 g/mol |
| Optical Rotation |
[a] = -37 (589 nm), -39 (578 nm), -45 (546 nm), -87 (436 nm), -182 (365 nm) (c = 0.5, CHCl3) |
| Reported Formula |
C19H28O5 |
| SMILES |
C1C([C@@]2([C@@]3([C@]([C@@]1(C)[H])([C@]2([C@@](CC[C@]3(C)COC(C)=O)(OC(C)=O)[H])C)[H])[H])[H])=O |
| SPLASH |
splash10-03dl-5920000000-87eca97a171db4ef0933 |
| Source of Spectrum |
G4-84-1093-4 |
| Wiley ID |
1884137 |
