CHEBI:74309 - pentadecanoyl-CoA(4−)

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ChEBI Name pentadecanoyl-CoA(4−) ChEBI ID CHEBI:74309 ChEBI ASCII Name pentadecanoyl-CoA(4-) Definition An acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate functions of pentadecanoyl-CoA. Stars This entity has been manually annotated by the ChEBI Team. Submitter abridge Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C36H60N7O17P3S Net Charge -4 Average Mass 987.88500 Monoisotopic Mass 987.30012 InChI InChI=1S/C36H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-27(45)64-20-19-38-26(44)17-18-39-34(48)31(47)36(2,3)22-57-63(54,55)60-62(52,53)56-21-25-30(59-61(49,50)51)29(46)35(58-25)43-24-42-28-32(37)40-23-41-33(28)43/h23-25,29-31,35,46-47H,4-22H2,1-3H3,(H,38,44)(H,39,48)(H,52,53)(H,54,55)(H2,37,40,41)(H2,49,50,51)/p-4/t25-,29-,30-,31+,35-/m1/s1 InChIKey VLBCUOVMSMAIJC-VTINEICCSA-J SMILES CCCCCCCCCCCCCCC(=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 ChEBI Ontology Outgoing pentadecanoyl-CoA(4−) (CHEBI:74309) is a long-chain fatty acyl-CoA(4−) (CHEBI:83139) pentadecanoyl-CoA(4−) (CHEBI:74309) is a saturated fatty acyl-CoA(4−) (CHEBI:77332) pentadecanoyl-CoA(4−) (CHEBI:74309) is conjugate base of pentadecanoyl-CoA (CHEBI:74574) Incoming pentadecanoyl-CoA (CHEBI:74574) is conjugate acid of pentadecanoyl-CoA(4−) (CHEBI:74309) IUPAC Name 3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pentadecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate) Synonyms Sources pentadecanoyl-CoA UniProt pentadecanoyl-coenzyme A(4−) ChEBI Manual Xref Database CPD-14724 MetaCyc View more database links Last Modified 28 October 2014