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

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ChEBI Name cis-tetradec-3-enoyl-CoA(4−)
ChEBI ID CHEBI:61968
ChEBI ASCII Name cis-tetradec-3-enoyl-CoA(4-)
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Eugeni Belda
Supplier Information
Download Molfile XML SDF
Formula C35H56N7O17P3S
Net Charge -4
Average Mass 971.84200
Monoisotopic Mass 971.26882
InChI InChI=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
InChIKey SSOCUKXLUZQJHU-AOVQAXKGSA-J
SMILES CCCCCCCCCC\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]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12
ChEBI Ontology
Outgoing 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 cis-tetradec-3-enoyl-CoA (CHEBI:62014) is conjugate acid of cis-tetradec-3-enoyl-CoA(4−) (CHEBI:61968)
Synonyms Sources
(3Z)-tetradecenoyl-CoA UniProt
(Z)-tetradec-3-enoyl-CoA ChEBI
(Z)-tetradec-3-enoyl-CoA tetraanion ChEBI
(Z)-tetradec-3-enoyl-CoA(4−) ChEBI
cis-tetradec-3-enoyl-CoA ChEBI
cis-tetradec-3-enoyl-CoA tetraanion ChEBI
n-C14:1CoA ChEBI
tetradecenoyl-CoA ChEBI
Last Modified
10 March 2017