| Properties | Image | Occurences in reactions |
MNX_ID | MNXM162248 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 56 |
in models (compartimentalized) |
56 |
|
formula | C23H27Cl2N3O9S |
charge | 0 |
mass | 591.08451 |
reference | biggM:HC02201 |
InChIKey | BIJQYNCUDQBFTN-KBPBESRZSA-N |
InChI | InChI=1S/C23H27Cl2N3O9S/c1-3-11(2)21(33)12-4-6-15(20(25)19(12)24)37-9-18(32)38-10-14(22(34)27-8-17(30)31)28-16(29)7-5-13(26)23(35)36/h4,6,13-14H,2-3,5,7-10,26H2,1H3,(H,27,34)(H,28,29)(H,30,31)(H,35,36)/t13-,14-/m0/s1 |
SMILES | C=C(CC)C(=O)c1ccc(OCC(=O)SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)c(Cl)c1Cl |
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