| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528109 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C25H31N3O3 |
charge | 0 |
mass | 421.23654 |
reference | chebi:98995 |
InChIKey | WELAGKOSDCWUQO-LGKPFJOYSA-N |
InChI | InChI=1S/C25H31N3O3/c1-3-14-27-21-15-28-20(23(27)22(19(21)16-29)24(30)26-4-2)13-12-18(25(28)31)11-10-17-8-6-5-7-9-17/h5-13,19,21-23,29H,3-4,14-16H2,1-2H3,(H,26,30)/t19-,21-,22+,23+/m1/s1 |
SMILES | CCCN1[C@@H]2Cn3c(ccc(C=Cc4ccccc4)c3=O)[C@H]1[C@@H](C(=O)NCC)[C@@H]2CO |
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