(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-oxidanyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-oxidanyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-hydroxy-butanoyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-hydroxy-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-hydroxy-butanoyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butyric acid Formula: C17H31N3O6 MolecularWeight: 373.44454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)C)C(=O)O)NC(=O)C(CCO)NC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CCO)NC(=O)C

InChI

InChI=1S/C17H31N3O6/c1-9(2)8-13(16(24)20-14(10(3)4)17(25)26)19-15(23)12(6-7-21)18-11(5)22/h9-10,12-14,21H,6-8H2,1-5H3,(H,18,22)(H,19,23)(H,20,24)(H,25,26)/t12-,13-,14-/m0/s1