methyl 7-[3,5-bis(oxidanyl)-2-(3-oxidanyl-6-thiophen-2-yl-hexyl)cyclopentyl]heptanoate

Systemtic Name: methyl 7-[3,5-bis(oxidanyl)-2-(3-oxidanyl-6-thiophen-2-yl-hexyl)cyclopentyl]heptanoate Openeye Name: methyl 7-[3,5-dihydroxy-2-[3-hydroxy-6-(2-thienyl)hexyl]cyclopentyl]heptanoate CAS Name: 7-[3,5-dihydroxy-2-(3-hydroxy-6-thiophen-2-ylhexyl)cyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[3,5-dihydroxy-2-(3-hydroxy-6-thiophen-2-ylhexyl)cyclopentyl]heptanoate Traditional Name: 7-[3,5-dihydroxy-2-[3-hydroxy-6-(2-thienyl)hexyl]cyclopentyl]enanthic acid methyl ester Formula: C23H38O5S MolecularWeight: 426.60982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC1C(CC(C1CCC(CCCC2=CC=CS2)O)O)O

Isomeric SMILES

COC(=O)CCCCCCC1C(CC(C1CCC(CCCC2=CC=CS2)O)O)O

InChI

InChI=1S/C23H38O5S/c1-28-23(27)12-5-3-2-4-11-19-20(22(26)16-21(19)25)14-13-17(24)8-6-9-18-10-7-15-29-18/h7,10,15,17,19-22,24-26H,2-6,8-9,11-14,16H2,1H3