3-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-2-oxidanyl-3-(7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propanoic acid

Systemtic Name: 3-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-2-oxidanyl-3-(7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propanoic acid Openeye Name: 3-[[(2S)-2-amino-3-methyl-butanoyl]amino]-2-hydroxy-3-(7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propanoic acid CAS Name: 3-[[(2S)-2-amino-3-methyl-1-oxobutyl]amino]-2-hydroxy-3-(7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propanoic acid IUPAC Name: 3-[[(2S)-2-amino-3-methylbutanoyl]amino]-2-hydroxy-3-(7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propanoic acid Traditional Name: 3-[[(2S)-2-amino-3-methyl-butanoyl]amino]-2-hydroxy-3-(7-keto-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)propionic acid Formula: C13H21N3O6 MolecularWeight: 315.32234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C1CN2C(O1)CC2=O)C(C(=O)O)O)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(C1CN2C(O1)CC2=O)C(C(=O)O)O)N

InChI

InChI=1S/C13H21N3O6/c1-5(2)9(14)12(19)15-10(11(18)13(20)21)6-4-16-7(17)3-8(16)22-6/h5-6,8-11,18H,3-4,14H2,1-2H3,(H,15,19)(H,20,21)/t6?,8?,9-,10?,11?/m0/s1