(4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrakis(oxidanyl)-2-oxidanylidene-nonanoic acid

Systemtic Name: (4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrakis(oxidanyl)-2-oxidanylidene-nonanoic acid Openeye Name: (4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrahydroxy-2-oxo-nonanoic acid CAS Name: (4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrahydroxy-2-oxononanoic acid IUPAC Name: (4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrahydroxy-2-oxononanoic acid Traditional Name: (4S,5R,6R,7R,8R)-5-acetamido-9-azido-4,6,7,8-tetrahydroxy-2-keto-pelargonic acid Formula: C11H18N4O8 MolecularWeight: 334.28262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@H]([C@H](CC(=O)C(=O)O)O)[C@H]([C@@H]([C@@H](CN=[N+]=[N-])O)O)O

InChI

InChI=1S/C11H18N4O8/c1-4(16)14-8(5(17)2-6(18)11(22)23)10(21)9(20)7(19)3-13-15-12/h5,7-10,17,19-21H,2-3H2,1H3,(H,14,16)(H,22,23)/t5-,7+,8+,9+,10+/m0/s1