(3R,4S)-4-oxidanyl-3-phenylsulfanyl-hexanoic acid

Systemtic Name: (3R,4S)-4-oxidanyl-3-phenylsulfanyl-hexanoic acid Openeye Name: (3R,4S)-4-hydroxy-3-phenylsulfanyl-hexanoic acid CAS Name: (3R,4S)-4-hydroxy-3-(phenylthio)hexanoic acid IUPAC Name: (3R,4S)-4-hydroxy-3-phenylsulfanylhexanoic acid Traditional Name: (3R,4S)-4-hydroxy-3-(phenylthio)hexanoic acid Formula: C12H16O3S MolecularWeight: 240.31864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(=O)O)SC1=CC=CC=C1)O

Isomeric SMILES

CC[C@@H]([C@@H](CC(=O)O)SC1=CC=CC=C1)O

InChI

InChI=1S/C12H16O3S/c1-2-10(13)11(8-12(14)15)16-9-6-4-3-5-7-9/h3-7,10-11,13H,2,8H2,1H3,(H,14,15)/t10-,11+/m0/s1