| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1107721 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
|
formula | C22H19N2O9 |
charge | 1 |
mass | 455.10851 |
reference | seedM:cpd09147 |
InChIKey | NUNHABHZPAHWOU-DXBBTUNJSA-O |
InChI | InChI=1S/C22H18N2O9/c1-7(25)32-20-15-13(19(30)21(22(20,3)31)33-8(2)26)12-14(16(15)24-23)18(29)11-9(17(12)28)5-4-6-10(11)27/h4-6,19-21,23,30-31H,1-3H3/p+1/t19-,20+,21+,22+/m0/s1 |
SMILES | CC(=O)O[C@@H]1c2c(c3c(=O)c4cccc(O)c4c(=O)c=3c2=[N+]=N)[C@H](O)[C@@H](OC(C)=O)[C@]1(C)O |
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