| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528564 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C27H31N3O6 |
charge | 0 |
mass | 493.22129 |
reference | chebi:101653 |
InChIKey | XMUOPSKEXGVNOG-MMTHZHQFSA-N |
InChI | InChI=1S/C27H31N3O6/c1-35-17-23(32)30-22-15-29-21(10-9-19(26(29)33)8-7-18-5-3-2-4-6-18)25(30)24(20(22)16-31)27(34)28-11-13-36-14-12-28/h2-10,20,22,24-25,31H,11-17H2,1H3/t20-,22-,24+,25+/m0/s1 |
SMILES | COCC(=O)N1[C@@H]2c3ccc(C=Cc4ccccc4)c(=O)n3C[C@H]1[C@H](CO)[C@H]2C(=O)N1CCOCC1 |
|