| Properties | Image | Occurences in reactions |
MNX_ID | MNXM161252 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H22FN5O3 |
charge | 0 |
mass | 423.17067 |
reference | keggD:D10730 |
InChIKey | KXBDTLQSDKGAEB-UHFFFAOYSA-N |
InChI | InChI=1S/C22H22FN5O3/c1-3-20(29)25-16-5-4-6-17(13-16)26-21-19(23)14-24-22(28-21)27-15-7-9-18(10-8-15)31-12-11-30-2/h3-10,13-14H,1,11-12H2,2H3,(H,25,29)(H2,24,26,27,28) |
SMILES | C=CC(=O)Nc1cccc(Nc2nc(Nc3ccc(OCCOC)cc3)ncc2F)c1 |
|