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CHEBI:61968 - cis-tetradec-3-enoyl-CoA(4−)

ChEBI IDCHEBI:61968
ChEBI Namecis-tetradec-3-enoyl-CoA(4−)
Stars
ASCII Namecis-tetradec-3-enoyl-CoA(4-)
DefinitionA monounsaturated fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of cis-tetradec-3-enoyl-CoA; major species at pH 7.3.
Last Modified10 March 2017
SubmitterEugeni Belda
DownloadsMolfile
FormulaC35H56N7O17P3S
Net Charge-4
Average Mass971.854
Monoisotopic Mass971.26882
SMILESCCCCCCCCCC/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/C35H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h13-14,22-24,28-30,34,45-46H,4-12,15-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/b14-13-/t24-,28-,29-,30+,34-/m1/s1
InChIKeySSOCUKXLUZQJHU-AOVQAXKGSA-J
ChEBI Ontology
Outgoing Relation(s)
cis-tetradec-3-enoyl-CoA(4−) (CHEBI:61968) is a cis-3-enoyl-CoA(4−) (CHEBI:85489)
cis-tetradec-3-enoyl-CoA(4−) (CHEBI:61968) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331)
cis-tetradec-3-enoyl-CoA(4−) (CHEBI:61968) is conjugate base of cis-tetradec-3-enoyl-CoA (CHEBI:62014)
Incoming Relation(s)
cis-tetradec-3-enoyl-CoA (CHEBI:62014) is conjugate acid of cis-tetradec-3-enoyl-CoA(4−) (CHEBI:61968)
Synonyms  Source
(Z)-tetradec-3-enoyl-CoAChEBI
cis-tetradec-3-enoyl-CoAChEBI
(Z)-tetradec-3-enoyl-CoA(4−)ChEBI
(Z)-tetradec-3-enoyl-CoA tetraanionChEBI
n-C14:1CoAChEBI
tetradecenoyl-CoAChEBI
UniProt Name  Source
(3Z)-tetradecenoyl-CoAUniProt