BMFYS5CAa016

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Upper classes : BM Basic Metabolites : BMFY Fatty acyl 脂肪酸 :  BMFYS straight chain 鎖状 (290 pages)



Glutaconyl-1-CoA
BMFYS5CAa016.png
Structural Information
Systematic Name (E) -5- [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] ethylsulfanyl] -5-oxopent-3-enoic acid
Common Name
  • Glutaconyl-1-CoA
  • 4-Carboxybut-2-enoyl-CoA
Symbol
Formula C26H40N7O19P3S
Exact Mass 879.1312
Average Mass 879.6188
SMILES C([C@H](C(NCCC(NCCSC(C=CCC(O)=O)=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
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Spectral Information
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