(5R,6S)-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (5R,6S)-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-keto-3-[2-(methoxymethyl)-1,4,5,6-tetrahydropyrimidin-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)O)C3CNC(=NC3)COC)O

Isomeric SMILES

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)C3CNC(=NC3)COC)O

InChI

InChI=1S/C15H21N3O5/c1-7(19)12-10-3-9(13(15(21)22)18(10)14(12)20)8-4-16-11(6-23-2)17-5-8/h7-8,10,12,19H,3-6H2,1-2H3,(H,16,17)(H,21,22)/t7-,10-,12-/m1/s1