| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1368305 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C21H18N2O8 |
| charge | 0 |
| mass | 426.381 |
| reference | envipathM:...5f4e1da1c5fc |
| InChIKey | AJCCSLUODCKXFP-JLHYYAGUSA-N |
| InChI | InChI=1S/C21H18N2O8/c1-28-10-13(21(27)29-2)12-7-8-15(25)19(26)20(12)31-18-9-17(22-11-23-18)30-16-6-4-3-5-14(16)24/h3-11,24-26H,1-2H3/b13-10+ |
| SMILES | [CH3:1][O:28]/[CH:10]=[C:13](\[c:12]1[cH:7][cH:8][c:15]([OH:25])[c:19]([OH:26])[c:20]1[O:31][c:18]1[cH:9][c:17]([O:30][c:16]2[cH:6][cH:4][cH:3][cH:5][c:14]2[OH:24])[n:22][cH:11][n:23]1)[C:21](=[O:27])[O:29][CH3:2] |
