2-(13-oxidanyltridecylamino)-3-sulfanyl-propanoic acid

Systemtic Name: 2-(13-oxidanyltridecylamino)-3-sulfanyl-propanoic acid Openeye Name: 2-(13-hydroxytridecylamino)-3-sulfanyl-propanoic acid CAS Name: 2-(13-hydroxytridecylamino)-3-mercaptopropanoic acid IUPAC Name: 2-(13-hydroxytridecylamino)-3-sulfanylpropanoic acid Traditional Name: 2-(13-hydroxytridecylamino)-3-mercapto-propionic acid Formula: C16H33NO3S MolecularWeight: 319.50312

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCNC(CS)C(=O)O)CCCCCCO

Isomeric SMILES

C(CCCCCCNC(CS)C(=O)O)CCCCCCO

InChI

InChI=1S/C16H33NO3S/c18-13-11-9-7-5-3-1-2-4-6-8-10-12-17-15(14-21)16(19)20/h15,17-18,21H,1-14H2,(H,19,20)