| SpectraBase Spectrum ID |
FyN2xrm7OEe |
| Name |
3.beta.-Senecioyloxy-1.beta.,10.beta.-epoxy-8.alpha.-hydroxyeremophil-7(11)-en-8.beta.(12)-olide |
| Appearance |
White needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O6 |
| InChI |
InChI=1S/C20H26O6/c1-10(2)6-16(21)24-14-7-15-19(25-15)9-20(23)13(11(3)17(22)26-20)8-18(19,5)12(14)4/h6,12,14-15,23H,7-9H2,1-5H3/t12-,14-,15+,18+,19+,20+/m0/s1 |
| InChIKey |
WPFQQVQRNHAKQJ-AUZPMGFGSA-N |
| Instrument Name |
HP-5988 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np010535l |
| Molecular Weight |
362.422 g/mol |
| Optical Rotation |
[a]D25 = -123 (c = 0.75, acetone) |
| SMILES |
O[C@@]12C(C[C@]3([C@]4([C@@](C[C@@]([C@@]3(C)[H])(OC(C=C(C)C)=O)[H])(O4)[H])C2)C)=C(C(O1)=O)C |
| SPLASH |
splash10-01sl-4090000000-d2b170b5ffdeaaeb4dc4 |
| Source of Spectrum |
G4-65-716-2 |
| Wiley ID |
1881130 |
