General Information
Compound IDOSC2215
Common NameOctanoyl-CoA
FormulaC29H50N7O17P3S
Formula at pH 7.2 (Predicted)C29H46N7O17P3S4-
Molecular Weight893.73
Structure
SMILESC1(OC(C(C(O)1)OP(=O)(O)O)COP(=O)(O)OP(O)(=O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCC)(n2(c3(c(nc2)c(N)ncn3)))
ReactionsOSR2715  OSR2889  OSR2926  OSR2936  
Pathways
KEGGrn00062  rn01100  rn00071  
Database Links
KEGGC01944  
ChEBI 15533
Pubchem Compound439608
Pubchem Substance5048