(2S,3R,4S)-3-acetamido-2-[(2S)-5-azanyl-5-oxidanylidene-pentan-2-yl]-5-methyl-4-oxidanyl-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2S,3R,4S)-3-acetamido-2-[(2S)-5-azanyl-5-oxidanylidene-pentan-2-yl]-5-methyl-4-oxidanyl-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2S,3R,4S)-3-acetamido-2-[(1S)-4-amino-1-methyl-4-oxo-butyl]-4-hydroxy-5-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2S,3R,4S)-3-acetamido-2-[(2S)-5-amino-5-oxopentan-2-yl]-4-hydroxy-5-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2S,3R,4S)-3-acetamido-2-[(2S)-5-amino-5-oxopentan-2-yl]-4-hydroxy-5-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2S,3R,4S)-3-acetamido-2-[(1S)-4-amino-4-keto-1-methyl-butyl]-4-hydroxy-5-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C14H22N2O6 MolecularWeight: 314.33428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(C(C1O)NC(=O)C)C(C)CCC(=O)N)C(=O)O

Isomeric SMILES

CC1=C(O[C@H]([C@@H]([C@H]1O)NC(=O)C)[C@@H](C)CCC(=O)N)C(=O)O

InChI

InChI=1S/C14H22N2O6/c1-6(4-5-9(15)18)12-10(16-8(3)17)11(19)7(2)13(22-12)14(20)21/h6,10-12,19H,4-5H2,1-3H3,(H2,15,18)(H,16,17)(H,20,21)/t6-,10+,11-,12-/m0/s1