5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]-6-oxidanylidene-1H-pyridine-2-carboxylic acid

Systemtic Name: 5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]-6-oxidanylidene-1H-pyridine-2-carboxylic acid Openeye Name: 5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]-6-oxo-1H-pyridine-2-carboxylic acid CAS Name: 5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)-3-pyrrolidinyl]-6-oxo-1H-pyridine-2-carboxylic acid IUPAC Name: 5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]-6-oxo-1H-pyridine-2-carboxylic acid Traditional Name: 5-[(3R,4S,5S)-5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]-6-keto-1H-pyridine-2-carboxylic acid Formula: C13H14N2O7 MolecularWeight: 310.25946

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(N1)C(=O)O)CC(=O)O)C2=CC=C(NC2=O)C(=O)O

Isomeric SMILES

C1[C@H]([C@@H]([C@H](N1)C(=O)O)CC(=O)O)C2=CC=C(NC2=O)C(=O)O

InChI

InChI=1S/C13H14N2O7/c16-9(17)3-6-7(4-14-10(6)13(21)22)5-1-2-8(12(19)20)15-11(5)18/h1-2,6-7,10,14H,3-4H2,(H,15,18)(H,16,17)(H,19,20)(H,21,22)/t6-,7-,10-/m0/s1