(2S)-4-methyl-2-[[(3S)-3-oxidanyltetradecanoyl]amino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[[(3S)-3-oxidanyltetradecanoyl]amino]pentanoic acid Openeye Name: (2S)-2-[[(3S)-3-hydroxytetradecanoyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[(3S)-3-hydroxy-1-oxotetradecyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[(3S)-3-hydroxytetradecanoyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[(3S)-3-hydroxytetradecanoyl]amino]-4-methyl-valeric acid Formula: C20H39NO4 MolecularWeight: 357.52796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC(CC(C)C)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H39NO4/c1-4-5-6-7-8-9-10-11-12-13-17(22)15-19(23)21-18(20(24)25)14-16(2)3/h16-18,22H,4-15H2,1-3H3,(H,21,23)(H,24,25)/t17-,18-/m0/s1