| Properties | Image | Occurences in reactions |
MNX_ID | MNXM161782 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C46H78F2N4O10S2 |
charge | 0 |
mass | 948.51274 |
reference | keggD:D06206 |
InChIKey | ODFOUAATRQAOLG-MMSVOLSESA-N |
InChI | InChI=1S/2C21H37FN2O3S.C4H4O4/c2*1-5-24(16-8-6-7-15-21(2,3)22)17-9-10-20(25)18-11-13-19(14-12-18)23-28(4,26)27;5-3(6)1-2-4(7)8/h2*11-14,20,23,25H,5-10,15-17H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*20-;/m00./s1 |
SMILES | CCN(CCCCCC(C)(C)F)CCC[C@H](O)c1ccc(NS(C)(=O)=O)cc1.CCN(CCCCCC(C)(C)F)CCC[C@H](O)c1ccc(NS(C)(=O)=O)cc1.O=C(O)/C=C/C(=O)O |
|