| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM163681 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
3 |
|
| formula | C22H31O6 |
| charge | -1 |
| mass | 391.21261 |
| reference | biggM:CE6444 |
| InChIKey | HFFDJQRQJYSADX-WUNASYCTSA-M |
| InChI | InChI=1S/C22H32O6/c1-2-3-4-5-6-7-8-9-10-11-18-19(21-16-20(18)27-28-21)14-12-17(26-25)13-15-22(23)24/h3-4,6-7,9-10,12,14,17-21,25H,2,5,8,11,13,15-16H2,1H3,(H,23,24)/p-1/b4-3-,7-6-,10-9?,14-12?/t17?,18-,19-,20?,21?/m0/s1 |
| SMILES | CC/C=C\C/C=C\CC=CC[C@@H]1C2CC(OO2)[C@H]1C=CC(CCC(=O)[O-])OO |
|
