6-azanyl-2-[(2-oxidanyl-3-sulfanyl-propanoyl)amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[(2-oxidanyl-3-sulfanyl-propanoyl)amino]hexanoic acid Openeye Name: 6-amino-2-[(2-hydroxy-3-sulfanyl-propanoyl)amino]hexanoic acid CAS Name: 6-amino-2-[(2-hydroxy-3-mercapto-1-oxopropyl)amino]hexanoic acid IUPAC Name: 6-amino-2-[(2-hydroxy-3-sulfanylpropanoyl)amino]hexanoic acid Traditional Name: 6-amino-2-[(2-hydroxy-3-mercapto-propanoyl)amino]hexanoic acid Formula: C9H18N2O4S MolecularWeight: 250.31522

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)O)NC(=O)C(CS)O

Isomeric SMILES

C(CCN)CC(C(=O)O)NC(=O)C(CS)O

InChI

InChI=1S/C9H18N2O4S/c10-4-2-1-3-6(9(14)15)11-8(13)7(12)5-16/h6-7,12,16H,1-5,10H2,(H,11,13)(H,14,15)