| Properties | Image | Occurences in reactions |
MNX_ID | MNXM42714 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C42H72N4O10S2 |
charge | 0 |
mass | 856.46899 |
reference | keggD:D02992 |
InChIKey | ZOFVDTOFQPSUIK-OMMCMWGNSA-N |
InChI | InChI=1S/2C19H34N2O3S.C4H4O4/c2*1-4-6-14-21(15-7-5-2)16-8-9-19(22)17-10-12-18(13-11-17)20-25(3,23)24;5-3(6)1-2-4(7)8/h2*10-13,19-20,22H,4-9,14-16H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*19-;/m11./s1 |
SMILES | CCCCN(CCCC)CCC[C@@H](O)c1ccc(NS(C)(=O)=O)cc1.CCCCN(CCCC)CCC[C@@H](O)c1ccc(NS(C)(=O)=O)cc1.O=C(O)/C=C/C(=O)O |
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