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The molecular formula is C3H6KNO6S.
The molecular weight is 223.25 g/mol.
The IUPAC name is potassium;[(2S)-2-amino-2-carboxyethyl] sulfate.
The InChI is InChI=1S/C3H7NO6S.K/c4-2(3(5)6)1-10-11(7,8)9;/h2H,1,4H2,(H,5,6)(H,7,8,9);/q;+1/p-1/t2-;/m0./s1.
The Canonical SMILES is C(C(C(=O)O)N)OS(=O)(=O)[O-].[K+].
The CAS number is 17436-02-1.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 7.
The topological polar surface area is 138Ų.
Yes, it is canonicalized.
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