| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528209 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C28H29FN4O3 |
charge | 0 |
mass | 488.22237 |
reference | chebi:99559 |
InChIKey | PGXATXJTQODNDY-AFQFEXIYSA-N |
InChI | InChI=1S/C28H29FN4O3/c29-22-6-2-1-5-19(22)20-9-10-23-26-25(27(35)31-13-17-7-8-17)21(16-34)24(15-33(23)28(20)36)32(26)14-18-4-3-11-30-12-18/h1-6,9-12,17,21,24-26,34H,7-8,13-16H2,(H,31,35)/t21-,24-,25+,26+/m1/s1 |
SMILES | O=C(NCC1CC1)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2Cc1cccnc1 |
|