calcium 4-methylsulfanyl-2-oxidanyl-butanoate

Systemtic Name: calcium 4-methylsulfanyl-2-oxidanyl-butanoate Openeye Name: calcium 2-hydroxy-4-methylsulfanyl-butanoate CAS Name: calcium 2-hydroxy-4-(methylthio)butanoate IUPAC Name: calcium 2-hydroxy-4-methylsulfanylbutanoate Traditional Name: calcium 2-hydroxy-4-(methylthio)butyrate Formula: C5H9CaO3S+ MolecularWeight: 189.26616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])O.[Ca+2]

Isomeric SMILES

CSCCC(C(=O)[O-])O.[Ca+2]

InChI

InChI=1S/C5H10O3S.Ca/c1-9-3-2-4(6)5(7)8;/h4,6H,2-3H2,1H3,(H,7,8);/q;+2/p-1