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calcium 2-oxidanyl-5-sulfanyl-pentanoate

calcium 2-oxidanyl-5-sulfanyl-pentanoate

Systemtic Name:calcium 2-oxidanyl-5-sulfanyl-pentanoate
Openeye Name:calcium 2-hydroxy-5-sulfanyl-pentanoate
CAS Name:calcium 2-hydroxy-5-mercaptopentanoate
IUPAC Name:calcium 2-hydroxy-5-sulfanylpentanoate
Traditional Name:calcium 2-hydroxy-5-mercapto-valerate
Formula: C5H9CaO3S+
MolecularWeight: 189.26616
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C5H10O3S.Ca/c6-4(5(7)8)2-1-3-9;/h4,6,9H,1-3H2,(H,7,8);/q;+2/p-1


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