| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528943 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C28H31N3O4 |
charge | 0 |
mass | 473.23146 |
reference | chebi:103322 |
InChIKey | KWDFMNKBUPRJCJ-HFOXQMJASA-N |
InChI | InChI=1S/C28H31N3O4/c1-2-5-18-10-11-23-24-21(15-30(23)26(18)33)22(16-32)25(31(24)27(34)19-8-9-19)28(35)29-13-12-17-6-3-4-7-20(17)14-29/h2-7,10-11,19,21-22,24-25,32H,8-9,12-16H2,1H3/t21-,22-,24+,25-/m0/s1 |
SMILES | CC=Cc1ccc2n(c1=O)C[C@H]1[C@H](CO)[C@@H](C(=O)N3CCc4ccccc4C3)N(C(=O)C3CC3)[C@@H]21 |
|