(2S,3S)-3-(hexadecanoylamino)-2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: (2S,3S)-3-(hexadecanoylamino)-2-oxidanyl-4-phenyl-butanoic acid Openeye Name: (2S,3S)-3-(hexadecanoylamino)-2-hydroxy-4-phenyl-butanoic acid CAS Name: (2S,3S)-2-hydroxy-3-(1-oxohexadecylamino)-4-phenylbutanoic acid IUPAC Name: (2S,3S)-3-(hexadecanoylamino)-2-hydroxy-4-phenylbutanoic acid Traditional Name: (2S,3S)-2-hydroxy-3-palmitamido-4-phenyl-butyric acid Formula: C26H43NO4 MolecularWeight: 433.62392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](C(=O)O)O

InChI

InChI=1S/C26H43NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24(28)27-23(25(29)26(30)31)21-22-18-15-14-16-19-22/h14-16,18-19,23,25,29H,2-13,17,20-21H2,1H3,(H,27,28)(H,30,31)/t23-,25-/m0/s1