SpectraBase Spectrum ID |
GWE3rsRaxR0 |
Name |
(3R,4S,5R)-3,4,5-tris(((Z)-2-methylbut-2-enoyl)oxy)cyclohex-1-enecarboxylic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H28O8 |
InChI |
InChI=1S/C22H28O8/c1-7-12(4)20(25)28-16-10-15(19(23)24)11-17(29-21(26)13(5)8-2)18(16)30-22(27)14(6)9-3/h7-10,16-18H,11H2,1-6H3,(H,23,24)/b12-7-,13-8-,14-9-/t16-,17-,18-/m1/s1 |
InChIKey |
VUTDZPWKZJTRIJ-XLDSHSSTSA-N |
Molecular Weight |
420.458 g/mol |
SMILES |
C1(=C[C@]([C@]([C@@](C1)(OC(=O)\C(=C/C)C)[H])(OC(=O)\C(=C/C)C)[H])(OC(=O)\C(=C/C)C)[H])C(O)=O |
SPLASH |
splash10-053r-9000000000-4bb75a7c809ce46a5feb |
Source of Spectrum |
Liliana Ruiz-Vasquez, et al. Phytochemistry, V.117, 2015, P.245-253 |
Synonyms |
(3R,4S,5R)-3,4,5-tris(((Z)-2-methylbut-2-enoyl)oxy)cyclohex-1-ene-1-carboxylic acid |
Wiley ID |
1815319 |