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CHEBI:747884 - 5,5,5-trifluoropentanoyl-CoA(4−)

Default Structure
ChEBI IDCHEBI:747884
ChEBI Name5,5,5-trifluoropentanoyl-CoA(4−)
Stars
ASCII Name5,5,5-trifluoropentanoyl-CoA(4-)
Last Modified23 June 2026
Submitterabridge
DownloadsMolfile
FormulaC26H37F3N7O17P3S
Net Charge-4
Average Mass901.597
Monoisotopic Mass901.11535
SMILESCC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCC(F)(F)F
InChIInChI=1S/C26H41F3N7O17P3S/c1-25(2,20(40)23(41)32-7-5-15(37)31-8-9-57-16(38)4-3-6-26(27,28)29)11-50-56(47,48)53-55(45,46)49-10-14-19(52-54(42,43)44)18(39)24(51-14)36-13-35-17-21(30)33-12-34-22(17)36/h12-14,18-20,24,39-40H,3-11H2,1-2H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/p-4/t14-,18-,19-,20+,24-/m1/s1
InChIKeyWOAWOTWOMUZGOC-CITAKDKDSA-J
ChEBI Ontology
Outgoing Relation(s)
5,5,5-trifluoropentanoyl-CoA(4−) (CHEBI:747884) is a organic molecular entity (CHEBI:50860)
UniProt Name  Source
5,5,5-trifluoropentanoyl-CoAUniProt