CHEBI:15543 - vinylacetyl-CoA

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ChEBI Name vinylacetyl-CoA ChEBI ID CHEBI:15543 Definition The S-vinylacetyl derivative of coenzyme A. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:9991, CHEBI:15311, CHEBI:27294 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 C25H40N7O17P3S Net Charge 0 Average Mass 835.60936 Monoisotopic Mass 835.14143 InChI InChI=1S/C25H40N7O17P3S/c1-4-5-16(34)53-9-8-27-15(33)6-7-28-23(37)20(36)25(2,3)11-46-52(43,44)49-51(41,42)45-10-14-19(48-50(38,39)40)18(35)24(47-14)32-13-31-17-21(26)29-12-30-22(17)32/h4,12-14,18-20,24,35-36H,1,5-11H2,2-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,18-,19-,20+,24-/m1/s1 InChIKey UATIGEHITDTAGF-CITAKDKDSA-N SMILES CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC=C 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 vinylacetyl-CoA (CHEBI:15543) has functional parent coenzyme A (CHEBI:15346) vinylacetyl-CoA (CHEBI:15543) is a butenoyl-CoA (CHEBI:22961) vinylacetyl-CoA (CHEBI:15543) is conjugate acid of vinylacetyl-CoA(4−) (CHEBI:57396) Incoming vinylacetyl-CoA(4−) (CHEBI:57396) is conjugate base of vinylacetyl-CoA (CHEBI:15543) IUPAC Name 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(but-3-enoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) Synonyms Sources 3-Butenoyl-CoA KEGG COMPOUND But-3-enoyl-CoA KEGG COMPOUND but-3-enoyl-CoA ChEBI Vinylacetyl-CoA KEGG COMPOUND Manual Xref Database C02331 KEGG COMPOUND View more database links Last Modified 04 August 2014