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(S)-2-Methylbutyryl-CoA Sodium Salt, TRC
Specifications
Specifications
| Chemical Name or Material | (S)-2-Methylbutyryl-CoA Sodium Salt |
| Molecular Formula | C26H44N7O17P3S . xNa |
| Quantity | 1 mg |
| Synonym | S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (2S)-2-Methylbutanethioate Sodium Salt |
| InChI Formula | InChI=1S/C26H44N7O17P3S.Na/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);/q;+1/p-1/t14-,15+,18+,19+,20-,24+;/m0./s1 |
| SMILES | O[C@@H]([C@H](N1C2=NC=NC(N)=C2N=C1)O[C@@H]3COP(OP(OCC(C)([C@H](C(NCCC(NCCSC([C@H](CC)C)=O)=O)=O)O)C)(O)=O)(O)=O)[C@@H]3OP(O)(O[Na])=O |
| IUPAC Name | sodium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy((hydroxy((R)-3-hydroxy-2,2-dimethyl-4-((3-((2-(((S)-2-methylbutanoyl)thio)ethyl)amino)-3-oxopropyl)amino)-4-oxobutoxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3-yl hydrogen phosphate |
| Molecular Weight (g/mol) | 873.6 |
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