| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM163108 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
0 |
|
| formula | C36H40MgN4O4 |
| charge | 0 |
| mass | 616.29 |
| reference | keggC:C21434 |
| InChIKey | QTRGNGZVYMENNF-IWFUKJHNSA-L |
| InChI | InChI=1S/C36H42N4O4.Mg/c1-8-21-28-15-29-23(11-16(2)3)18(5)25(37-29)14-30-33(20(7)41)19(6)27(38-30)13-26-17(4)22(9-10-32(43)44)35(39-26)24-12-31(42)34(21)36(24)40-28;/h13-17,20,22,41H,8-12H2,1-7H3,(H3,37,38,39,40,42,43,44);/q;+2/p-2/t17-,20?,22-;/m0./s1 |
| SMILES | CCc1c2c3n4/c1=C\C1=N/C(=C\c5c(C(C)O)c(C)c(n5[Mg]4)/C=C4\N=C(C=3CC2=O)[C@@H](CCC(=O)O)[C@@H]4C)C(C)=C1CC(C)C |
|
