7-[2-oxidanyl-5-(2-oxidanyl-3-phenyl-propyl)sulfanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-oxidanyl-5-(2-oxidanyl-3-phenyl-propyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-hydroxy-5-(2-hydroxy-3-phenyl-propyl)sulfanyl-cyclopentyl]heptanoic acid CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-3-phenylpropyl)thio]cyclopentyl]heptanoic acid IUPAC Name: 7-[2-hydroxy-5-(2-hydroxy-3-phenylpropyl)sulfanylcyclopentyl]heptanoic acid Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-3-phenyl-propyl)thio]cyclopentyl]enanthic acid Formula: C21H32O4S MolecularWeight: 380.54138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1O)CCCCCCC(=O)O)SCC(CC2=CC=CC=C2)O

Isomeric SMILES

C1CC(C(C1O)CCCCCCC(=O)O)SCC(CC2=CC=CC=C2)O

InChI

InChI=1S/C21H32O4S/c22-17(14-16-8-4-3-5-9-16)15-26-20-13-12-19(23)18(20)10-6-1-2-7-11-21(24)25/h3-5,8-9,17-20,22-23H,1-2,6-7,10-15H2,(H,24,25)