| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528825 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C26H28N4O3 |
charge | 0 |
mass | 444.21614 |
reference | chebi:103098 |
InChIKey | ZMVBPFYUTZNCSY-KAKDDGLXSA-N |
InChI | InChI=1S/C26H28N4O3/c31-17-20-22-16-29-21(10-6-11-23(29)32)25(30(22)15-19-9-4-5-13-27-19)24(20)26(33)28-14-12-18-7-2-1-3-8-18/h1-11,13,20,22,24-25,31H,12,14-17H2,(H,28,33)/t20-,22-,24+,25+/m1/s1 |
SMILES | O=C(NCCc1ccccc1)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2Cc1ccccn1 |
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