| SpectraBase Spectrum ID |
3Os4kwk3Tgm |
| Name |
8.beta.-(4'-acetoxyangelyloxy)-2.alpha.,3.beta.-dihydroxy-6.beta.H,7.alpha.H-germacra-1(10)E,4E,11(13)-triene-6,12-olide |
| Alternate Name(s) |
Eupachinilide J |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O8 |
| InChI |
InChI=1S/C22H28O8/c1-11-8-16(24)20(25)13(3)10-18-19(14(4)22(27)30-18)17(9-11)29-21(26)12(2)6-7-28-15(5)23/h6,8,10,16-20,24-25H,4,7,9H2,1-3,5H3/b11-8+,12-6-,13-10+/t16-,17-,18-,19-,20-/m1/s1 |
| InChIKey |
RTTZVQOUFITRBN-BEQCSDHQSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0304159 |
| Molecular Weight |
420.458 g/mol |
| Optical Rotation |
[a]D20 = +40.8 (c = 0.55, CH3OH) |
| Reported Formula |
C20H28O8 |
| SMILES |
O[C@]1([C@@](\C(=C\[C@]2(OC(C([C@@]2([C@@](C\C(=C\1)C)(OC(=O)\C(C)=C/COC(C)=O)[H])[H])=C)=O)[H])C)(O)[H])[H] |
| SPLASH |
splash10-000t-9130000000-d5ca9be52c4d75538acc |
| Source of Spectrum |
G4-67-643-10 |
| Wiley ID |
1881707 |
