CHEBI:86143 - (14Z)-hexadecenoyl-CoA

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ChEBI Name (14Z)-hexadecenoyl-CoA
ChEBI ID CHEBI:86143
ChEBI ASCII Name (14Z)-hexadecenoyl-CoA
Definition A hexadecenoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (14Z)-hexadecenoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C37H64N7O17P3S
Net Charge 0
Average Mass 1003.92700
Monoisotopic Mass 1003.32923
InChI InChI=1S/C37H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44/h4-5,24-26,30-32,36,47-48H,6-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/b5-4-/t26-,30-,31-,32+,36-/m1/s1
InChIKey HIHIIKWURVKNRP-CTCHSOFBSA-N
SMILES C\C=C/CCCCCCCCCCCCC(=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 (14Z)-hexadecenoyl-CoA (CHEBI:86143) is a hexadecenoyl-CoA (CHEBI:24549)
(14Z)-hexadecenoyl-CoA (CHEBI:86143) is conjugate acid of (14Z)-hexadecenoyl-CoA(4−) (CHEBI:85926)
Incoming (14Z)-hexadecenoyl-CoA(4−) (CHEBI:85926) is conjugate base of (14Z)-hexadecenoyl-CoA (CHEBI:86143)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(14Z)-hexadec-14-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
(14Z)-hexadecenoyl-coenzyme A ChEBI
(Z)-hexadec-14-enoyl-CoA ChEBI
(Z)-hexadec-14-enoyl-coenzyme A ChEBI
Manual Xref Database
CPD-17468 MetaCyc
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Last Modified
02 February 2018