CHEBI:75332 - nonadecanoyl-CoA

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ChEBI Name nonadecanoyl-CoA
ChEBI ID CHEBI:75332
Definition A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of pentadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H72N7O17P3S
Net Charge 0
Average Mass 1048.02300
Monoisotopic Mass 1047.39183
InChI InChI=1S/C40H72N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(49)68-24-23-42-30(48)21-22-43-38(52)35(51)40(2,3)26-61-67(58,59)64-66(56,57)60-25-29-34(63-65(53,54)55)33(50)39(62-29)47-28-46-32-36(41)44-27-45-37(32)47/h27-29,33-35,39,50-51H,4-26H2,1-3H3,(H,42,48)(H,43,52)(H,56,57)(H,58,59)(H2,41,44,45)(H2,53,54,55)/t29-,33-,34-,35+,39-/m1/s1
InChIKey YUJZGRUJMWKAJF-ZOUGCNRJSA-N
SMILES CCCCCCCCCCCCCCCCCCC(=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 nonadecanoyl-CoA (CHEBI:75332) has functional parent nonadecanoic acid (CHEBI:39246)
nonadecanoyl-CoA (CHEBI:75332) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348)
nonadecanoyl-CoA (CHEBI:75332) is a long-chain fatty acyl-CoA (CHEBI:33184)
nonadecanoyl-CoA (CHEBI:75332) is a saturated fatty acyl-CoA (CHEBI:231546)
nonadecanoyl-CoA (CHEBI:75332) is conjugate acid of nonadecanoyl-CoA(4−) (CHEBI:75105)
Incoming nonadecanoyl-CoA(4−) (CHEBI:75105) is conjugate base of nonadecanoyl-CoA (CHEBI:75332)
IUPAC Name
3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(nonadecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)
Synonym Source
nonadecanoyl-coenzyme A ChEBI
Last Modified
07 June 2024