| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528357 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C25H28N4O4 |
charge | 0 |
mass | 448.21106 |
reference | chebi:100435 |
InChIKey | YVZLAXVGGRSZTP-YJMBLLCNSA-N |
InChI | InChI=1S/C25H28N4O4/c30-13-18-20-12-28-19(8-7-17(25(28)33)16-2-1-9-26-11-16)22(29(20)24(32)15-5-6-15)21(18)23(31)27-10-14-3-4-14/h1-2,7-9,11,14-15,18,20-22,30H,3-6,10,12-13H2,(H,27,31)/t18-,20-,21+,22+/m1/s1 |
SMILES | O=C(NCC1CC1)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1N2C(=O)C1CC1 |
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