Sulforaphane-N-acetylcysteine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 3
Total Number of Articles : 2
PubChem 45040443
Molecular Formula

C11H20N2O4S3

SMILES

CC(=O)NC(CSC(=S)NCCCCS(=O)C)C(=O)O

InChI

InChI=1S/C11H20N2O4S3/c1-8(14)13-9(10(15)16)7-19-11(18)12-5-3-4-6-20(2)17/h9H,3-7H2,1-2H3,(H,12,18)(H,13,14)(H,15,16)

synonyms
  • 334829-66-2
  • D,L-Sulforaphane N-Acetyl-L-cysteine
  • Sulforaphane-N-acetylcysteine
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Properties
Property Value
MW 340.5 g/mol
HBD 3
HBA 7
Rotatable Bond Count 10
Exact Mass 340.05852064 g/mol
Monoisotopic Mass 340.05852064 g/mol
Heavy Atom Count 20
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 377
xlogp -0.2
Topological Polar Surface Area 172