| SpectraBase Spectrum ID |
EgtL2Fmsuud |
| Name |
(3R,4S,5R)-4-(Hexanoyloxy)-3,5-bis(((Z)-2-methylbut-2-enoyl)oxy)cyclohex-1-enecarboxylic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.209717982 u |
| Formula |
C23H32O8 |
| InChI |
InChI=1S/C23H32O8/c1-6-9-10-11-19(24)31-20-17(29-22(27)14(4)7-2)12-16(21(25)26)13-18(20)30-23(28)15(5)8-3/h7-8,12,17-18,20H,6,9-11,13H2,1-5H3,(H,25,26)/b14-7-,15-8-/t17-,18-,20-/m1/s1 |
| InChIKey |
GVIHVFDRDXVUFJ-LUYVJNCJSA-N |
| Molecular Weight |
436.501 g/mol |
| SMILES |
C1(=C[C@]([C@]([C@@](C1)(OC(=O)\C(=C/C)C)[H])(OC(=O)CCCCC)[H])(OC(=O)\C(=C/C)C)[H])C(O)=O |
