CHEBI:15380 - succinyl-CoA

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ChEBI Name succinyl-CoA ChEBI ID CHEBI:15380 Definition An ω-carboxyacyl-CoA having succinoyl as the S-acyl component. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:45541, CHEBI:9310, CHEBI:10746, CHEBI:15127, CHEBI:26811 Supplier Information ZINC000095832019 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C25H40N7O19P3S Net Charge 0 Average Mass 867.60816 Monoisotopic Mass 867.13125 InChI InChI=1S/C25H40N7O19P3S/c1-25(2,20(38)23(39)28-6-5-14(33)27-7-8-55-16(36)4-3-15(34)35)10-48-54(45,46)51-53(43,44)47-9-13-19(50-52(40,41)42)18(37)24(49-13)32-12-31-17-21(26)29-11-30-22(17)32/h11-13,18-20,24,37-38H,3-10H2,1-2H3,(H,27,33)(H,28,39)(H,34,35)(H,43,44)(H,45,46)(H2,26,29,30)(H2,40,41,42)/t13-,18-,19-,20+,24-/m1/s1 InChIKey VNOYUJKHFWYWIR-ITIYDSSPSA-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)CCC(O)=O Metabolite of Species Details Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Escherichia coli (NCBI:txid562) See: PubMed Roles Classification Chemical Role(s): acyl donor Any donor that can transfer acyl groups between molecular entities. (via acyl-CoA ) Biological Role(s): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). inhibitor A substance that diminishes the rate of a chemical reaction. View more via ChEBI Ontology ChEBI Ontology Outgoing succinyl-CoA (CHEBI:15380) has functional parent coenzyme A (CHEBI:15346) succinyl-CoA (CHEBI:15380) has role Escherichia coli metabolite (CHEBI:76971) succinyl-CoA (CHEBI:15380) has role inhibitor (CHEBI:35222) succinyl-CoA (CHEBI:15380) has role mouse metabolite (CHEBI:75771) succinyl-CoA (CHEBI:15380) is a ω-carboxyacyl-CoA (CHEBI:37555) succinyl-CoA (CHEBI:15380) is conjugate acid of succinyl-CoA(5−) (CHEBI:57292) Incoming succinyl-CoA(5−) (CHEBI:57292) is conjugate base of succinyl-CoA (CHEBI:15380) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources Coenzyme A, S-(hydrogen butanedioate) ChemIDplus S-(3-carboxy-propionyl)-CoA ChEBI S-(3-Carboxy-propionyl)-coenzym-A ChEBI S-(3-carboxypropionyl)-coenzyme-A ChEBI S-(hydrogen succinyl)-CoA ChEBI S-(Hydrogen succinyl)coenzyme A ChemIDplus Succinyl coenzyme A KEGG COMPOUND Succinyl-CoA KEGG COMPOUND succinyl-CoA JCBN SUCCINYL-COENZYME A PDBeChem Succinyl-coenzyme A ChemIDplus Manual Xrefs Databases C00019546 KNApSAcK C00091 KEGG COMPOUND c0344 UM-BBD DB03699 DrugBank SCA PDBeChem View more database links Registry Numbers Types Sources 604-98-8 CAS Registry Number KEGG COMPOUND 604-98-8 CAS Registry Number ChemIDplus 78365 Reaxys Registry Number Reaxys Citations Last Modified 27 January 2016