| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM45969 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C15H17ClN8O6S4 |
| charge | 0 |
| mass | 567.98424 |
| reference | keggD:D01961 |
| InChIKey | LBWIJMWZWJRRMO-AWXOXGPMSA-N |
| InChI | InChI=1S/C15H14N8O5S4.ClH.H2O/c16-15-18-5(2-30-15)8(21-28)11(24)19-9-12(25)23-10(14(26)27)6(3-29-13(9)23)31-4-32-7-1-17-22-20-7;;/h1-2,9,13,28H,3-4H2,(H2,16,18)(H,19,24)(H,26,27)(H,17,20,22);1H;1H2/b21-8-;;/t9-,13-;;/m1../s1 |
| SMILES | Cl.Nc1nc(/C(=N/O)C(=O)N[C@@H]2C(=O)N3C(C(=O)O)=C(SCSc4cnn[nH]4)CS[C@H]23)cs1.O |
|
