General Information
Compound IDOSC2406
Common Name3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA
Synonyms Names3alpha,7alpha,12alpha-Trihydroxy-24-oxo-5beta-cholestanoyl-CoA
FormulaC48H78N7O21P3S
Formula at pH 7.2 (Predicted)C48H74N7O21P3S4-
Molecular Weight1214.153
Structure
SMILESOC1CCC2(C(C1)CC(C1C2CC(O)C2(C1CCC2C(CCC(=O)C(C(=O)SCCNC(=O)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O)C)C)C)O)C
ReactionsOSR3013  
Pathways
KEGGrn00120  rn01100  
Database Links
KEGGC05467  
ChEBI 27379
Pubchem Compound440690
Pubchem Substance7827