| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM163645 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
3 |
|
| formula | C22H31O6 |
| charge | -1 |
| mass | 391.21261 |
| reference | biggM:CE6449 |
| InChIKey | MEVBPAJZOYZPMH-PXFASYKZSA-M |
| InChI | InChI=1S/C22H32O6/c1-2-18-19(21-16-20(18)27-28-21)15-14-17(26-25)12-10-8-6-4-3-5-7-9-11-13-22(23)24/h3-4,7-10,14-15,17-21,25H,2,5-6,11-13,16H2,1H3,(H,23,24)/p-1/b4-3-,9-7-,10-8-,15-14?/t17-,18+,19-,20?,21?/m0/s1 |
| SMILES | CC[C@H]1C2CC(OO2)[C@H]1C=C[C@H](C/C=C\C/C=C\C/C=C\CCC(=O)[O-])OO |
|
