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CHEBI:747887 - 4,4,5,5,5-pentafluoropentanoyl-CoA(4-)

Default Structure
ChEBI IDCHEBI:747887
ChEBI Name4,4,5,5,5-pentafluoropentanoyl-CoA(4-)
Stars
Last Modified12 June 2026
Submitterabridge
DownloadsMolfile
FormulaC26H35F5N7O17P3S
Net Charge-4
Average Mass937.577
Monoisotopic Mass937.09651
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)CCC(F)(F)C(F)(F)F
InChIInChI=1S/C26H39F5N7O17P3S/c1-24(2,19(42)22(43)34-6-4-14(39)33-7-8-59-15(40)3-5-25(27,28)26(29,30)31)10-52-58(49,50)55-57(47,48)51-9-13-18(54-56(44,45)46)17(41)23(53-13)38-12-37-16-20(32)35-11-36-21(16)38/h11-13,17-19,23,41-42H,3-10H2,1-2H3,(H,33,39)(H,34,43)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/p-4/t13-,17-,18-,19+,23-/m1/s1
InChIKeyWMKWBPGMXCHTMJ-IEXPHMLFSA-J
ChEBI Ontology
Outgoing Relation(s)
4,4,5,5,5-pentafluoropentanoyl-CoA(4-) (CHEBI:747887) is a acyl-CoA(4−) (CHEBI:58342)
UniProt Name  Source
4,4,5,5,5-pentafluoropentanoyl-CoAUniProt