(2S,3S)-2-(hexadecanoylamino)-3-methyl-pentanoic acid

Systemtic Name: (2S,3S)-2-(hexadecanoylamino)-3-methyl-pentanoic acid Openeye Name: (2S,3S)-2-(hexadecanoylamino)-3-methyl-pentanoic acid CAS Name: (2S,3S)-3-methyl-2-(1-oxohexadecylamino)pentanoic acid IUPAC Name: (2S,3S)-2-(hexadecanoylamino)-3-methylpentanoic acid Traditional Name: (2S,3S)-3-methyl-2-palmitamido-valeric acid Formula: C22H43NO3 MolecularWeight: 369.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(C(C)CC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)O

InChI

InChI=1S/C22H43NO3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-20(24)23-21(22(25)26)19(3)5-2/h19,21H,4-18H2,1-3H3,(H,23,24)(H,25,26)/t19-,21-/m0/s1