5-(2-azidoethanoylamino)-2-methoxy-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid

Systemtic Name: 5-(2-azidoethanoylamino)-2-methoxy-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid Openeye Name: 5-[(2-azidoacetyl)amino]-4-hydroxy-2-methoxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid CAS Name: 5-[(2-azido-1-oxoethyl)amino]-4-hydroxy-2-methoxy-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxylic acid IUPAC Name: 5-[(2-azidoacetyl)amino]-4-hydroxy-2-methoxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid Traditional Name: 5-[(2-azidoacetyl)amino]-4-hydroxy-2-methoxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid Formula: C12H20N4O9 MolecularWeight: 364.3086

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CC(C(C(O1)C(C(CO)O)O)NC(=O)CN=[N+]=[N-])O)C(=O)O

Isomeric SMILES

COC1(CC(C(C(O1)C(C(CO)O)O)NC(=O)CN=[N+]=[N-])O)C(=O)O

InChI

InChI=1S/C12H20N4O9/c1-24-12(11(22)23)2-5(18)8(15-7(20)3-14-16-13)10(25-12)9(21)6(19)4-17/h5-6,8-10,17-19,21H,2-4H2,1H3,(H,15,20)(H,22,23)