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3-Ketopalmitoyl-CoA, TRC

Product Code. 30406225
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Product Code. 30406225 Supplier Toronto Research Chemicals Supplier No. TRCK1980032.5MG

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High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

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Chemical Identifiers

CAS 34619-89-1
Molecular Formula C37H64N7O18P3S
Molecular Weight (g/mol) 1019.93
Synonym 3-Oxohexadecanoyl-CoA, 3-Oxopalmitoyl-CoA, S-(3-Ketohexadecanoyl)coenzyme A, beta-Ketopalmitoyl-coenzyme A
IUPAC Name S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxohexadecanethioate
SMILES CCCCCCCCCCCCCC(=O)CC(=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)n2cnc3c(N)ncnc23

Specifications

Quantity 2.5 mg
InChI Formula InChI=1S/C37H64N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h23-24,26,30-32,36,48-49H,4-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/t26-,30-,31-,32+,36-/m1/s1
Formula Weight 1019.3241
Chemical Name or Material 3-Ketopalmitoyl-CoA
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