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S-Phenylmercapturic Acid

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For Research Use Only | Not For Clinical Use
CATAPS4775808
CAS4775-80-8
Structure
IUPAC Name(2R)-2-acetamido-3-phenylsulfanylpropanoic acid
Molecular Weight239.29
Molecular FormulaC11H13NO3S
Canonical SMILESCC(=O)N[C@@H](CSc1ccccc1)C(=O)O
InChIInChI=1S/C11H13NO3S/c1-8(13)12-10(11(14)15)7-16-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)/t10-/m0/s1
Accurate Mass239.0616
FormatNeat
SubcategoryPharmaceutical, Chiral molecules, Amino acids
TypeMetabolite
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