| SpectraBase Spectrum ID |
wR8FZgsNM |
| Name |
8.beta.-(4'-hydroxytiglyloxy)-14-chrorine-3.alpha.,4.alpha.-epoxy-2.beta.,10.alpha.-dihydroxy-1.alpha.H,5.alpha.H,6.beta.H,7.alpha.H-guai-11(13)-ene-6,12-olide |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25ClO8 |
| InChI |
InChI=1S/C20H25ClO8/c1-8(4-5-22)17(24)27-10-6-20(26,7-21)12-13(19(3)16(29-19)14(12)23)15-11(10)9(2)18(25)28-15/h4,10-16,22-23,26H,2,5-7H2,1,3H3/b8-4+/t10-,11-,12+,13+,14+,15+,16-,19+,20+/m1/s1 |
| InChIKey |
JNLCQVGOEVZPLZ-GQEGKNDZSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0304159 |
| Molecular Weight |
428.865 g/mol |
| Optical Rotation |
[a]D20 = -59.4 (c = 0.60, CH3OH) |
| Reported Formula |
C20H25ClO8 |
| SMILES |
O[C@]1([C@]2([C@@]([C@@]3([C@@]([C@](OC(\C(=C\CO)C)=O)(C1)[H])(C(C(O3)=O)=C)[H])[H])([C@]1([C@@]([C@]2(O)[H])(O1)[H])C)[H])[H])CCl |
| SPLASH |
splash10-0002-9110000000-a787f581bf2bb0a49561 |
| Source of Spectrum |
G4-67-643-5 |
| Synonyms |
Eupachinilide E |
| Wiley ID |
1881712 |
