SpectraBase Spectrum ID |
68XvNSNxQj7 |
Name |
8.beta.-tigloyloxy-14-chloro-2.beta.,10.alpha.-dihydroxy-1.alpha.H,5.alpha.H,6.beta.H,7.alpha.H-guai-3,11(13)-dien-6,12-olide |
Alternate Name(s) |
Eupalinilide E |
Appearance |
White powder |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H25ClO6 |
InChI |
InChI=1S/C20H25ClO6/c1-5-9(2)18(23)26-13-7-20(25,8-21)16-12(22)6-10(3)14(16)17-15(13)11(4)19(24)27-17/h5-6,12-17,22,25H,4,7-8H2,1-3H3/b9-5+/t12-,13-,14+,15-,16-,17-,20+/m1/s1 |
InChIKey |
RQLHOJWFBMNYHW-PBDZIAQESA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np040023h |
Molecular Weight |
396.867 g/mol |
Optical Rotation |
[a]D20 = -56.2 (c = 1.0, CHCl3) |
Reported Formula |
C20H25ClO6 |
SMILES |
O[C@]1([C@]2([C@](C(=C[C@]2(O)[H])C)([C@@]2([C@@]([C@@](C1)(OC(\C(C)=C\C)=O)[H])(C(C(O2)=O)=C)[H])[H])[H])[H])CCl |
SPLASH |
splash10-0560-9120000000-5e0a84201653fedf7f4c |
Source of Spectrum |
G4-67-1474-5 |
Wiley ID |
1881878 |