2-METHYL-ACETO-ACETYL-COA

Metabolite 2-METHYL-ACETO-ACETYL-COA

• smiles:
  • CC(C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O)C(=O)C
• common name:
  • 2-methylacetoacetyl-CoA
• molecular weight:
  • 861.604
• inchi key:
  • InChIKey=NHNODHRSCRALBF-NQNBQJKNSA-J
• Synonym(s):
  • 2-methyl-3-acetoacetyl-CoA
  • 2-methylacetoacetyl coenzyme A

Reaction(s) known to consume the compound

• ACCAT

Reaction(s) of unknown directionality

• HMNOS
• 1.1.1.178-RXN
• METHYLACETOACETYLCOATHIOL-RXN

External links

• CAS : 6712-01-2
• HMDB : HMDB01157
• LIGAND-CPD:
  • C03344
• METABOLIGHTS : MTBLC57335
• PUBCHEM:
  • 45266568
• CHEBI:
  • 57335
• REFMET : 2-Methylacetoacetyl-CoA

"CC(C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O)C(=O)C" cannot be used as a page name in this wiki.