[(1R)-3-methyl-1-[[(2S,3R)-3-oxidanyl-2-[(5-phenylpyridin-3-yl)carbonylamino]butanoyl]amino]butyl]boronic acid

Systemtic Name: [(1R)-3-methyl-1-[[(2S,3R)-3-oxidanyl-2-[(5-phenylpyridin-3-yl)carbonylamino]butanoyl]amino]butyl]boronic acid Openeye Name: [(1R)-1-[[(2S,3R)-3-hydroxy-2-[(5-phenylpyridine-3-carbonyl)amino]butanoyl]amino]-3-methyl-butyl]boronic acid CAS Name: [(1R)-1-[[(2S,3R)-3-hydroxy-1-oxo-2-[[oxo-(5-phenyl-3-pyridinyl)methyl]amino]butyl]amino]-3-methylbutyl]boronic acid IUPAC Name: [(1R)-1-[[(2S,3R)-3-hydroxy-2-[(5-phenylpyridine-3-carbonyl)amino]butanoyl]amino]-3-methylbutyl]boronic acid Traditional Name: [(1R)-1-[[(2S,3R)-3-hydroxy-2-[(5-phenylnicotinoyl)amino]butanoyl]amino]-3-methyl-butyl]boronic acid Formula: C21H28BN3O5 MolecularWeight: 413.27512

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)NC(=O)C(C(C)O)NC(=O)C1=CN=CC(=C1)C2=CC=CC=C2)(O)O

Isomeric SMILES

B([C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)C1=CN=CC(=C1)C2=CC=CC=C2)(O)O

InChI

InChI=1S/C21H28BN3O5/c1-13(2)9-18(22(29)30)24-21(28)19(14(3)26)25-20(27)17-10-16(11-23-12-17)15-7-5-4-6-8-15/h4-8,10-14,18-19,26,29-30H,9H2,1-3H3,(H,24,28)(H,25,27)/t14-,18+,19+/m1/s1