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Roquefortine D
MNXM148503 is deprecated and replaced by MNXM1100613
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1100613 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 4 |
| in models (compartimentalized) |
0 |
|
| formula | C22H25N5O2 |
| charge | 0 |
| mass | 391.20083 |
| reference | keggC:C22163 |
| InChIKey | IQVNREJWRXOHEO-UHFFFAOYSA-N |
| InChI | InChI=1S/C22H25N5O2/c1-4-21(2,3)22-10-17-18(28)25-16(9-13-11-23-12-24-13)19(29)27(17)20(22)26-15-8-6-5-7-14(15)22/h4-8,11-12,16-17,20,26H,1,9-10H2,2-3H3,(H,23,24)(H,25,28) |
| SMILES | C=CC(C)(C)C12CC3C(=O)NC(Cc4c[nH]cn4)C(=O)N3C1Nc1ccccc12 |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
