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CHEBI:233791 - (3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoA(4−)

ChEBI IDCHEBI:233791
ChEBI Name(3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoA(4−)
Stars
ASCII Name(3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC37H54N7O17P3S
Net Charge-4
Average Mass993.860
Monoisotopic Mass993.25317
SMILESCC/C=C\C/C=C\C/C=C\CC/C=C/CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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-]
InChIInChI=1S/C37H58N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44/h5-6,8-9,11-12,15-16,24-26,30-32,36,47-48H,4,7,10,13-14,17-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/p-4/b6-5-,9-8-,12-11-,16-15+/t26-,30-,31-,32+,36-/m1/s1
InChIKeyRDUFPHXVOIEKMV-YBQPJAEWSA-J
ChEBI Ontology
Outgoing Relation(s)
(3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoA(4−) (CHEBI:233791) is a trans-3-enoyl-CoA(4−) (CHEBI:58521)
(3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoA(4−) (CHEBI:233791) is a polyunsaturated fatty acyl-CoA(4−) (CHEBI:77330)
Synonym  Source
CoA 16:4(3E,7Z,10Z,13Z)(4−)SUBMITTER
UniProt Name  Source
(3E,7Z,10Z,13Z)-hexadecatetraenoyl-CoAUniProt