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CHEBI:139025 - 2-hydroxytetradecanoyl-CoA

ChEBI IDCHEBI:139025
ChEBI Name2-hydroxytetradecanoyl-CoA
Stars
DefinitionA hydroxy fatty-acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-hydroxytetradecanoic acid.
Last Modified10 November 2017
SubmitterSteve
DownloadsMolfile
FormulaC35H62N7O18P3S
Net Charge0
Average Mass993.901
Monoisotopic Mass993.30849
SMILESCCCCCCCCCCCCC(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/C35H62N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-23(43)34(48)64-18-17-37-25(44)15-16-38-32(47)29(46)35(2,3)20-57-63(54,55)60-62(52,53)56-19-24-28(59-61(49,50)51)27(45)33(58-24)42-22-41-26-30(36)39-21-40-31(26)42/h21-24,27-29,33,43,45-46H,4-20H2,1-3H3,(H,37,44)(H,38,47)(H,52,53)(H,54,55)(H2,36,39,40)(H2,49,50,51)/t23?,24-,27-,28-,29+,33-/m1/s1
InChIKeyFTHAAWMGKVTJIF-UCXPIXOESA-N
Roles Classification
Chemical Role:
acyl donor  Any donor that can transfer acyl groups between molecular entities.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxytetradecanoyl-CoA (CHEBI:139025) is a hydroxy fatty acyl-CoA (CHEBI:61902)
2-hydroxytetradecanoyl-CoA (CHEBI:139025) is a long-chain fatty acyl-CoA (CHEBI:33184)
2-hydroxytetradecanoyl-CoA (CHEBI:139025) is conjugate acid of 2-hydroxytetradecanoyl-CoA(4−) (CHEBI:138300)
Incoming Relation(s)
2-hydroxytetradecanoyl-CoA(4−) (CHEBI:138300) is conjugate base of 2-hydroxytetradecanoyl-CoA (CHEBI:139025)
IUPAC Name 
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxytetradecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms  Source
2-hydroxytetradecanoyl-coenzyme AChEBI
2-hydroxymyristoyl-coenzyme AChEBI
2-hydroxymyristoyl-CoAChEBI