| SpectraBase Spectrum ID |
F9hJHfZOp19 |
| Name |
8.beta.-(4'-hydroxytigloyloxy)-3.alpha.,4.alpha.-epoxy-2.beta.,10.alpha.,14-trihydroxy- 1.alpha.H,5.alpha.H,6.beta.H,7.alpha.H-guai-11(13)-en-6,12-olide |
| Alternate Name(s) |
Eupalinilide I |
| Appearance |
Colorless gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O9 |
| InChI |
InChI=1S/C20H26O9/c1-8(4-5-21)17(24)27-10-6-20(26,7-22)12-13(19(3)16(29-19)14(12)23)15-11(10)9(2)18(25)28-15/h4,10-16,21-23,26H,2,5-7H2,1,3H3/b8-4+/t10-,11-,12+,13+,14+,15+,16-,19+,20+/m1/s1 |
| InChIKey |
VGEKTNDFEQYUQI-GQEGKNDZSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np040023h |
| Molecular Weight |
410.419 g/mol |
| Optical Rotation |
[a]D20 = -43.4 (c = 1.0, CH3OH) |
| Reported Formula |
C20H26O9 |
| SMILES |
O[C@]1(CO)C[C@]([C@@]2([C@@]([C@@]3([C@]1([C@@]([C@@]1([C@@]3(C)O1)[H])(O)[H])[H])[H])(OC(C2=C)=O)[H])[H])(OC(=O)\C(C)=C\CO)[H] |
| SPLASH |
splash10-006t-9211000000-52856996e15b353ff828 |
| Source of Spectrum |
G4-67-1475-9 |
| Wiley ID |
1881882 |
