7-[(1S,2R)-2-[3-(4-methoxyphenoxy)-2-methyl-2-oxidanyl-propyl]sulfanyl-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1S,2R)-2-[3-(4-methoxyphenoxy)-2-methyl-2-oxidanyl-propyl]sulfanyl-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[(1S,2R)-3-hydroxy-2-[2-hydroxy-3-(4-methoxyphenoxy)-2-methyl-propyl]sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[(1S,2R)-3-hydroxy-2-[[2-hydroxy-3-(4-methoxyphenoxy)-2-methylpropyl]thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[(1S,2R)-3-hydroxy-2-[2-hydroxy-3-(4-methoxyphenoxy)-2-methylpropyl]sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[(1S,2R)-3-hydroxy-2-[[2-hydroxy-3-(4-methoxyphenoxy)-2-methyl-propyl]thio]-5-keto-cyclopentyl]enanthic acid Formula: C23H34O7S MolecularWeight: 454.57686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)OC)(CSC2C(CC(=O)C2CCCCCCC(=O)O)O)O

Isomeric SMILES

CC(COC1=CC=C(C=C1)OC)(CS[C@@H]2[C@H](C(=O)CC2O)CCCCCCC(=O)O)O

InChI

InChI=1S/C23H34O7S/c1-23(28,14-30-17-11-9-16(29-2)10-12-17)15-31-22-18(19(24)13-20(22)25)7-5-3-4-6-8-21(26)27/h9-12,18,20,22,25,28H,3-8,13-15H2,1-2H3,(H,26,27)/t18-,20?,22+,23?/m0/s1