(3S,4S,5S,6R)-6-(4-azanylphenoxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (3S,4S,5S,6R)-6-(4-azanylphenoxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (3S,4S,5S,6R)-6-(4-aminophenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (3S,4S,5S,6R)-6-(4-aminophenoxy)-3,4,5-trihydroxy-2-oxanecarboxylic acid IUPAC Name: (3S,4S,5S,6R)-6-(4-aminophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid Traditional Name: (3S,4S,5S,6R)-6-(4-aminophenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid Formula: C12H15NO7 MolecularWeight: 285.25

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)OC2C(C(C(C(O2)C(=O)O)O)O)O

Isomeric SMILES

C1=CC(=CC=C1N)O[C@@H]2[C@H]([C@H]([C@@H](C(O2)C(=O)O)O)O)O

InChI

InChI=1S/C12H15NO7/c13-5-1-3-6(4-2-5)19-12-9(16)7(14)8(15)10(20-12)11(17)18/h1-4,7-10,12,14-16H,13H2,(H,17,18)/t7-,8-,9-,10?,12-/m0/s1