CHEBI:15477 - 2-methylbutanoyl-CoA

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ChEBI Name 2-methylbutanoyl-CoA ChEBI ID CHEBI:15477 Definition A short-chain, methyl-branched fatty acyl-CoA having 2-methylbutanoyl as the S-acyl group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:1201, CHEBI:11616, CHEBI:19693 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 C26H44N7O17P3S Net Charge 0 Average Mass 851.65182 Monoisotopic Mass 851.17273 InChI InChI=1S/C26H44N7O17P3S/c1-5-14(2)25(38)54-9-8-28-16(34)6-7-29-23(37)20(36)26(3,4)11-47-53(44,45)50-52(42,43)46-10-15-19(49-51(39,40)41)18(35)24(48-15)33-13-32-17-21(27)30-12-31-22(17)33/h12-15,18-20,24,35-36H,5-11H2,1-4H3,(H,28,34)(H,29,37)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41)/t14?,15-,18-,19-,20+,24-/m1/s1 InChIKey LYNVNYDEQMMNMZ-XGXNYEOVSA-N SMILES CCC(C)C(=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 2-methylbutanoyl-CoA (CHEBI:15477) has functional parent 2-methylbutyric acid (CHEBI:37070) 2-methylbutanoyl-CoA (CHEBI:15477) has functional parent coenzyme A (CHEBI:15346) 2-methylbutanoyl-CoA (CHEBI:15477) is a methyl-branched fatty acyl-CoA (CHEBI:25271) 2-methylbutanoyl-CoA (CHEBI:15477) is a short-chain fatty acyl-CoA (CHEBI:61905) 2-methylbutanoyl-CoA (CHEBI:15477) is conjugate acid of 2-methylbutanoyl-CoA(4−) (CHEBI:57336) Incoming (S)-2-methylbutanoyl-CoA (CHEBI:90222) is a 2-methylbutanoyl-CoA (CHEBI:15477) 2-methylbutanoyl-CoA(4−) (CHEBI:57336) is conjugate base of 2-methylbutanoyl-CoA (CHEBI:15477) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources 2-Methylbutanoyl-CoA KEGG COMPOUND 2-methylbutanoyl-coenzyme A ChEBI 2-Methylbutyryl-CoA KEGG COMPOUND 2-methylbutyryl-coenzyme A ChEBI S-(2-methylbutanoyl)-CoA ChEBI Manual Xrefs Databases 2-METHYL-BUTYRYL-COA MetaCyc C01033 KEGG COMPOUND HMDB0001041 HMDB View more database links Citation Type Source 17335222 PubMed citation Europe PMC Last Modified 05 November 2015