| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM163648 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
3 |
|
| formula | C22H31O6 |
| charge | -1 |
| mass | 391.21261 |
| reference | biggM:CE6450 |
| InChIKey | XSYYKXJCJWVDMD-DRUKYYDMSA-M |
| InChI | InChI=1S/C22H32O6/c1-2-3-8-11-17(26-25)14-15-19-18(20-16-21(19)28-27-20)12-9-6-4-5-7-10-13-22(23)24/h3,5-9,14-15,17-21,25H,2,4,10-13,16H2,1H3,(H,23,24)/p-1/b7-5-,8-3-,9-6?,15-14+/t17?,18-,19-,20?,21?/m1/s1 |
| SMILES | CC/C=C\CC(/C=C/[C@H]1C2CC(OO2)[C@@H]1CC=CC/C=C\CCC(=O)[O-])OO |
|
