2-(icosanoylamino)-3-oxidanyl-propanoic acid

Systemtic Name: 2-(icosanoylamino)-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-(icosanoylamino)propanoic acid CAS Name: 3-hydroxy-2-(1-oxoeicosylamino)propanoic acid IUPAC Name: 3-hydroxy-2-(icosanoylamino)propanoic acid Traditional Name: 2-(eicosanoylamino)-3-hydroxy-propionic acid Formula: C23H45NO4 MolecularWeight: 399.6077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C23H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(26)24-21(20-25)23(27)28/h21,25H,2-20H2,1H3,(H,24,26)(H,27,28)