| SpectraBase Spectrum ID |
2g3RPaMbDhx |
| Name |
(1R,3R,4R,7R,8R,11S)-3,4:7,8-Diepoxy-13-ketodolabell-12(18)-ene |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O3 |
| InChI |
InChI=1S/C20H30O3/c1-12(2)17-13-6-8-19(4)15(22-19)7-9-20(5)16(23-20)11-18(13,3)10-14(17)21/h13,15-16H,6-11H2,1-5H3/t13-,15-,16-,18+,19-,20-/m1/s1 |
| InChIKey |
YUVBUOIJKQKXOJ-COMPOGLGSA-N |
| Instrument Name |
Agilent 5977A MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.1c00199 |
| Molecular Weight |
318.457 g/mol |
| Optical Rotation |
[a]D21 = -21 (c = 1.14, CHCl3) |
| SMILES |
C1[C@]2([C@](C[C@@]3([C@@](CC[C@@]4([C@@](C1)(O4)C)[H])(O3)C)[H])(CC(C2=C(C)C)=O)C)[H] |
| SPLASH |
splash10-0ap4-6901000000-6e35b4356e8af618e6bc |
| Source of Spectrum |
G4-84-1379-3 |
| Wiley ID |
1884150 |
