Feedback

Trecetilide fumarate (USAN)

PropertiesImageOccurences in reactions
MNX_IDMNXM161782Image of MNXM161782
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC46H78F2N4O10S2
charge0
mass948.51274
referencekeggD:D06206
InChIKeyODFOUAATRQAOLG-MMSVOLSESA-N
InChIInChI=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
SMILESCCN(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
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
kegg.drug:D06206
keggD:D06206
Trecetilide fumarate (USAN)
keggD:M_D06206 secondary/obsolete/fantasy identifier