BMFYS4ESa004

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



Acetoacetyl-CoA
BMFYS4ESa004.png
Structural Information
Systematic 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-oxobutanethioate
Common Name
  • Acetoacetyl-CoA
  • Acetoacetyl coenzyme A
  • 3-Acetoacetyl-CoA
Symbol
Formula C25H40N7O18P3S
Exact Mass 851.1363
Average Mass 851.6087
SMILES n(c3N)cnc(c32)n(cn2)[C@@H]([C@@H]1O)O[C@@H]([C@H]1OP(O)(O)=O)COP(OP(O)(=O)OCC([C@@H](O)C(NCCC(NCCSC(CC(C)=O)=O)=O)=O)(C)C)(O)=O
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