| Properties | Image | Occurences in reactions |
MNX_ID | MNXM528948 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H28N4O4S |
charge | 0 |
mass | 444.18313 |
reference | chebi:103327 |
InChIKey | YAZSZKUPWYSKIW-BEKAIBRUSA-N |
InChI | InChI=1S/C22H28N4O4S/c1-3-4-14-5-6-16-20-19(21(28)24-7-9-30-2)15(13-27)17(11-26(16)22(14)29)25(20)12-18-23-8-10-31-18/h3-6,8,10,15,17,19-20,27H,7,9,11-13H2,1-2H3,(H,24,28)/t15-,17-,19+,20+/m1/s1 |
SMILES | CC=Cc1ccc2n(c1=O)C[C@@H]1[C@@H](CO)[C@H](C(=O)NCCOC)[C@H]2N1Cc1nccs1 |
|