calcium zinc 2-acetamido-3-sulfanyl-propanoic acid hydrate

Systemtic Name: calcium zinc 2-acetamido-3-sulfanyl-propanoic acid hydrate Openeye Name: calcium zinc 2-acetamido-3-sulfanyl-propanoic acid hydrate CAS Name: calcium zinc 2-acetamido-3-mercaptopropanoic acid hydrate IUPAC Name: calcium zinc 2-acetamido-3-sulfanylpropanoic acid hydrate Traditional Name: calcium zinc 2-acetamido-3-mercapto-propionic acid hydrate Formula: C5H11CaNO4SZn+4 MolecularWeight: 286.69714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CS)C(=O)O.O.[Ca+2].[Zn+2]

Isomeric SMILES

CC(=O)NC(CS)C(=O)O.O.[Ca+2].[Zn+2]

InChI

InChI=1S/C5H9NO3S.Ca.H2O.Zn/c1-3(7)6-4(2-10)5(8)9;;;/h4,10H,2H2,1H3,(H,6,7)(H,8,9);;1H2;/q;+2;;+2