2-(docosanoylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(docosanoylamino)-4-methyl-pentanoic acid Openeye Name: 2-(docosanoylamino)-4-methyl-pentanoic acid CAS Name: 4-methyl-2-(1-oxodocosylamino)pentanoic acid IUPAC Name: 2-(docosanoylamino)-4-methylpentanoic acid Traditional Name: 2-(docosanoylamino)-4-methyl-valeric acid Formula: C28H55NO3 MolecularWeight: 453.7412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C28H55NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(30)29-26(28(31)32)24-25(2)3/h25-26H,4-24H2,1-3H3,(H,29,30)(H,31,32)