| SpectraBase Spectrum ID |
4vF2QX0DD6F |
| Name |
Methyl picrotoxate |
| Alternate Name(s) |
Methyl (1R,2R,3S,6S,7S,9R,10R,11S)-1,6-dihydroxy-10-isopropenyl-2-methyl-5-oxo-4,8-dioxatetracyclo[5.4.1.0(2,6).0(3,9)]dodecane-11-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O7 |
| InChI |
InChI=1S/C16H20O7/c1-6(2)8-9(12(17)21-4)15(19)5-7-16(20)13(18)23-11(10(8)22-7)14(15,16)3/h7-11,19-20H,1,5H2,2-4H3/t7-,8-,9+,10+,11+,14+,15+,16-/m0/s1 |
| InChIKey |
QYUXGWKGANGESL-INEXGCEFSA-N |
| Molecular Weight |
324.329 g/mol |
| SMILES |
O[C@@]12[C@]3([C@@]4([C@]([C@@]([C@]([C@]3(OC2=O)[H])(O[C@]1(C4)[H])[H])(C(=C)C)[H])(C(=O)OC)[H])O)C |
| SPLASH |
splash10-0059-7901000000-c68c5c3916f1a16cd1f9 |
| Source of Spectrum |
F-54-3701-0 |
| Wiley ID |
806413 |
