(2E,7R,11R)-phytenoyl-CoA(4−) (CHEBI:760726)

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CHEBI:760726 - (2E,7R,11R)-phytenoyl-CoA(4−)

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ChEBI ID	CHEBI:760726
ChEBI Name	(2E,7R,11R)-phytenoyl-CoA(4−)
Stars
Definition	A multi-methyl-branched fatty acyl-CoA(4−) arising from deprotonation of phosphate and diphosphate functions of (2E,7R,11R)-phytenoyl-CoA; major species at pH 7.3.
Last Modified	12 August 2026
Submitter	nhn
Downloads	Molfile

Formula	C41H68N7O17P3S
Net Charge	-4
Average Mass	1056.016
Monoisotopic Mass	1055.36272
SMILES	C/C(=C\C(=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-])CCC[C@H](C)CCC[C@H](C)CCCC(C)C
InChI	InChI=1S/C41H72N7O17P3S/c1-26(2)11-8-12-27(3)13-9-14-28(4)15-10-16-29(5)21-32(50)69-20-19-43-31(49)17-18-44-39(53)36(52)41(6,7)23-62-68(59,60)65-67(57,58)61-22-30-35(64-66(54,55)56)34(51)40(63-30)48-25-47-33-37(42)45-24-46-38(33)48/h21,24-28,30,34-36,40,51-52H,8-20,22-23H2,1-7H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/b29-21+/t27-,28-,30-,34-,35-,36+,40-/m1/s1
InChIKey	NYZPDFUAZACYOT-PEAQSEFFSA-J

ChEBI Ontology

Outgoing Relation(s)
	(2E,7R,11R)-phytenoyl-CoA(4−) (CHEBI:760726) is a 2,3-trans-enoyl CoA(4−) (CHEBI:58856)
	(2E,7R,11R)-phytenoyl-CoA(4−) (CHEBI:760726) is a multi-methyl-branched fatty acyl-CoA(4−) (CHEBI:68458)

Synonym	Source
(2E,7R,11R)-3,7,11,15-tetramethyl-hexadecenoyl-CoA(4−)	SUBMITTER

UniProt Name	Source
(2E,7R,11R)-phytenoyl-CoA	UniProt

Citations