| Properties | Image | Occurences in reactions |
MNX_ID | MNXM339866 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C27H29N3O3 |
charge | 0 |
mass | 443.22089 |
reference | chebi:130186 |
InChIKey | BUQGVIZHJOSDOL-BUALBWRZSA-N |
InChI | InChI=1S/C27H29N3O3/c1-29-24-7-6-20(19-4-3-5-21(15-19)33-2)16-23(24)27-22(25(29)17-31)10-13-30(27)26(32)14-18-8-11-28-12-9-18/h3-9,11-12,15-16,22,25,27,31H,10,13-14,17H2,1-2H3/t22-,25+,27-/m1/s1 |
SMILES | COc1cccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)Cc2ccncc2)[C@H](CO)N3C)c1 |
|