| Properties | Image | Occurences in reactions |
MNX_ID | MNXM529690 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C31H33N3O6 |
charge | 0 |
mass | 543.23694 |
reference | chebi:119659 |
InChIKey | LVQXARYEWHFWNX-BALWLHIASA-N |
InChI | InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/t20-,21+,28+/m0/s1 |
SMILES | C[C@H]1CN([C@H](C)CO)C(=O)c2cc(C=Cc3ccccc3)cnc2O[C@@H]1CN(C)C(=O)c1ccc2c(c1)OCO2 |
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