CPD-195

Metabolite CPD-195

• common name:
  • octanoate
• inchi key:
  • InChIKey=WWZKQHOCKIZLMA-UHFFFAOYSA-M
• smiles:
  • CCCCCCCC(=O)[O-]
• molecular weight:
  • 143.205
• Synonym(s):
  • octanoate (n-C8:0)
  • C-8 acid
  • n-caprylic acid
  • caprylic acid
  • capryloate
  • 1-heptanecarboxylic acid
  • neo-fat 8
  • octanoic acid
  • n-octanoic acid
  • n-octic acid
  • octoic acid
  • n-octylic acid

Reaction(s) known to produce the compound

• R222-RXN

External links

• PUBCHEM:
  • 119389
• METABOLIGHTS : MTBLC25646
• LIGAND-CPD:
  • C06423
• CHEBI:
  • 25646
• GO-TERMS : (REFMET "Caprylic acid" NIL midford 3701443689 NIL NIL)
• CHEMSPIDER:
  • 106634
• CAS : 124-07-2
• BIGG : octa
• HMDB : HMDB00482
• NCI:
  • 5024
• UM-BBD-CPD : c0047

Property "Smiles" (as page type) with input value "CCCCCCCC(=O)[O-" contains invalid characters or is incomplete and therefore can cause unexpected results during a query or annotation process.