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CHEBI:85032 - 2-carboxymyristoyl-CoA

ChEBI IDCHEBI:85032
ChEBI Name2-carboxymyristoyl-CoA
Stars
DefinitionA 2-carboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-carboxymyristic acid.
Last Modified26 February 2015
SubmitterSteve
DownloadsMolfile
FormulaC36H62N7O19P3S
Net Charge0
Average Mass1021.911
Monoisotopic Mass1021.30340
SMILESCCCCCCCCCCCCC(C(=O)O)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
InChIInChI=1S/C36H62N7O19P3S/c1-4-5-6-7-8-9-10-11-12-13-14-23(34(48)49)35(50)66-18-17-38-25(44)15-16-39-32(47)29(46)36(2,3)20-59-65(56,57)62-64(54,55)58-19-24-28(61-63(51,52)53)27(45)33(60-24)43-22-42-26-30(37)40-21-41-31(26)43/h21-24,27-29,33,45-46H,4-20H2,1-3H3,(H,38,44)(H,39,47)(H,48,49)(H,54,55)(H,56,57)(H2,37,40,41)(H2,51,52,53)/t23?,24-,27-,28-,29+,33-/m1/s1
InChIKeyLOCLARNIYQVTDB-UCXPIXOESA-N
Roles Classification
Chemical Role:
acyl donor  Any donor that can transfer acyl groups between molecular entities.
ChEBI Ontology
Outgoing Relation(s)
2-carboxymyristoyl-CoA (CHEBI:85032) is a 2-carboxyacyl-CoA (CHEBI:84127)
2-carboxymyristoyl-CoA (CHEBI:85032) is conjugate acid of 2-carboxymyristoyl-CoA(5−) (CHEBI:84097)
Incoming Relation(s)
2-carboxymyristoyl-CoA(5−) (CHEBI:84097) is conjugate base of 2-carboxymyristoyl-CoA (CHEBI:85032)
Synonyms  Source
2-carboxytetradecanoyl-CoAChEBI
2-carboxytetradcecanoyl-coenzyme AChEBI
2-carboxymyristoyl-coenzyme AChEBI