(4S,5R,6R)-5-acetamido-4,6,7-tris(oxidanyl)-2-oxidanylidene-heptanoic acid

Systemtic Name: (4S,5R,6R)-5-acetamido-4,6,7-tris(oxidanyl)-2-oxidanylidene-heptanoic acid Openeye Name: (4S,5R,6R)-5-acetamido-4,6,7-trihydroxy-2-oxo-heptanoic acid CAS Name: (4S,5R,6R)-5-acetamido-4,6,7-trihydroxy-2-oxoheptanoic acid IUPAC Name: (4S,5R,6R)-5-acetamido-4,6,7-trihydroxy-2-oxoheptanoic acid Traditional Name: (4S,5R,6R)-5-acetamido-4,6,7-trihydroxy-2-keto-enanthic acid Formula: C9H15NO7 MolecularWeight: 249.2179

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(CC(=O)C(=O)O)O)C(CO)O

Isomeric SMILES

CC(=O)N[C@H]([C@H](CC(=O)C(=O)O)O)[C@H](CO)O

InChI

InChI=1S/C9H15NO7/c1-4(12)10-8(7(15)3-11)5(13)2-6(14)9(16)17/h5,7-8,11,13,15H,2-3H2,1H3,(H,10,12)(H,16,17)/t5-,7-,8+/m0/s1