| Properties | Image | Occurences in reactions |
MNX_ID | MNXM160664 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H27N7O6 |
charge | 0 |
mass | 485.20228 |
reference | metacycM:CPD-15353 |
InChIKey | UKSNPQPAROIFBP-NDHCZCPUSA-N |
InChI | InChI=1S/C22H27N7O6/c1-28(2)19-17-20(25-9-24-19)29(10-26-17)22-18(32)16(15(8-30)35-22)27-21(33)12(23)6-11-4-5-14(34-3)13(31)7-11/h4-7,9-10,15-16,18,22,30-32H,8,23H2,1-3H3,(H,27,33)/b12-6-/t15-,16-,18-,22-/m1/s1 |
SMILES | COc1ccc(/C=C(\N)C(=O)N[C@@H]2[C@@H](CO)O[C@@H](n3cnc4c(N(C)C)ncnc43)[C@@H]2O)cc1O |
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