CHEBI:29126 - trans-dec-3-enoyl-CoA

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ChEBI Name trans-dec-3-enoyl-CoA
ChEBI ID CHEBI:29126
ChEBI ASCII Name trans-dec-3-enoyl-CoA
Definition An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-dec-3-enoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C31H52N7O17P3S
Net Charge 0
Average Mass 919.76884
Monoisotopic Mass 919.23533
InChI InChI=1S/C31H52N7O17P3S/c1-4-5-6-7-8-9-10-11-22(40)59-15-14-33-21(39)12-13-34-29(43)26(42)31(2,3)17-52-58(49,50)55-57(47,48)51-16-20-25(54-56(44,45)46)24(41)30(53-20)38-19-37-23-27(32)35-18-36-28(23)38/h9-10,18-20,24-26,30,41-42H,4-8,11-17H2,1-3H3,(H,33,39)(H,34,43)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/b10-9+/t20-,24-,25-,26+,30-/m1/s1
InChIKey CQGVNMQHZQJNII-ZJZQAHHTSA-N
SMILES CCCCCC\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
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing trans-dec-3-enoyl-CoA (CHEBI:29126) has functional parent trans-dec-3-enoic acid (CHEBI:37809)
trans-dec-3-enoyl-CoA (CHEBI:29126) is a trans-3-enoyl-CoA (CHEBI:27700)
trans-dec-3-enoyl-CoA (CHEBI:29126) is a medium-chain fatty acyl-CoA (CHEBI:61907)
trans-dec-3-enoyl-CoA (CHEBI:29126) is a monounsaturated fatty acyl-CoA (CHEBI:139575)
trans-dec-3-enoyl-CoA (CHEBI:29126) is conjugate acid of trans-dec-3-enoyl-CoA(4−) (CHEBI:84793)
Incoming trans-dec-3-enoyl-CoA(4−) (CHEBI:84793) is conjugate base of trans-dec-3-enoyl-CoA (CHEBI:29126)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3E)-dec-3-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
3-trans-decenoyl-CoA ChEBI
3-trans-decenoyl-coenzyme A ChEBI
trans-3-decenoyl-CoA ChEBI
trans-3-decenoyl-coenzyme A ChEBI
trans-dec-3-enoyl-coenzyme A ChEBI
Manual Xref Database
HMDB0002137 HMDB
View more database links
Registry Number Type Source
11165738 Reaxys Registry Number Reaxys
Last Modified
05 February 2018
General Comment
2011-05-03 An intermediate in fatty acid metabolism, it is the substrate of medium-chain acyl-CoA dehydrogenase (MCAD, EC 1.3.99.3). --http://www.hmdb.ca/metabolites/HMDB02137.