(2S,3S,4R,5R)-2-(hydroxymethyl)-1-methyl-piperidin-1-ium-3,4,5-triol

Systemtic Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-1-methyl-piperidin-1-ium-3,4,5-triol Openeye Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-1-methyl-piperidin-1-ium-3,4,5-triol CAS Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-1-methylpiperidin-1-ium-3,4,5-triol IUPAC Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-1-methylpiperidin-1-ium-3,4,5-triol Traditional Name: (2S,3S,4R,5R)-1-methyl-2-methylol-piperidin-1-ium-3,4,5-triol Formula: C7H16NO4+ MolecularWeight: 178.20624

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(C(C(C1CO)O)O)O

Isomeric SMILES

C[NH+]1C[C@H]([C@H]([C@H]([C@@H]1CO)O)O)O

InChI

InChI=1S/C7H15NO4/c1-8-2-5(10)7(12)6(11)4(8)3-9/h4-7,9-12H,2-3H2,1H3/p+1/t4-,5+,6-,7+/m0/s1