7-[2-(3,3-dimethyl-2-oxidanyl-heptyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-(3,3-dimethyl-2-oxidanyl-heptyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethyl-heptyl)sulfanyl-cyclopentyl]heptanoic acid CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethylheptyl)thio]cyclopentyl]heptanoic acid IUPAC Name: 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethylheptyl)sulfanylcyclopentyl]heptanoic acid Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethyl-heptyl)thio]cyclopentyl]enanthic acid Formula: C21H40O4S MolecularWeight: 388.6049

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CSC1CCC(C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CCCCC(C)(C)C(CSC1CCC(C1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C21H40O4S/c1-4-5-14-21(2,3)19(23)15-26-18-13-12-17(22)16(18)10-8-6-7-9-11-20(24)25/h16-19,22-23H,4-15H2,1-3H3,(H,24,25)