BMFYB4ESa004

Latest revision as of 17:31, 16 June 2010

2-Methylbutanoyl-CoA

Structural Information
Systematic Name	S- [2- [3- [ [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] 2-methylbutanethioic acid
Common Name	2-Methylbutanoyl-CoA 2-Methylbutyryl-CoA 2-Methyl-butanoyl-CoA
Symbol
Formula	C26H44N7O17P3S
Exact Mass	851.1727
Average Mass	851.6518
SMILES	`C([C@H](C(NCCC(NCCSC(C(CC)C)=O)=O)=O)O)(C)(C)COP(OP(OC[C@H]([C@@H](OP(O)(O)=O)3)O[C@H]([C@@H]3O)n(c21)cnc(c(N)ncn2)1)(O)=O)(O)=O`
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

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 {{Metabolite
-|SysName=2-Methyl-butanoyl-CoA
+|SysName=S- [2- [3- [ [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] 2-methylbutanethioic acid
-|Common Name=&&2-Methylbutanoyl-CoA&&2-Methylbutyryl-CoA&&
+|Common Name=&&2-Methylbutanoyl-CoA&&2-Methylbutyryl-CoA&&2-Methyl-butanoyl-CoA&&
-|CAS=?
+|CAS=6712-02-3
 |KEGG=C01033
 }}