7-[2-[(E)-4,4-dimethyl-3-(oxan-2-yloxy)oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-4,4-dimethyl-3-(oxan-2-yloxy)oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-4,4-dimethyl-3-tetrahydropyran-2-yloxy-oct-1-en-6-ynyl]-3-hydroxy-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-4,4-dimethyl-3-(2-oxanyloxy)oct-1-en-6-ynyl]-3-hydroxy-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-4,4-dimethyl-3-(oxan-2-yloxy)oct-1-en-6-ynyl]-3-hydroxy-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-4,4-dimethyl-3-tetrahydropyran-2-yloxy-oct-1-en-6-ynyl]-3-hydroxy-5-keto-cyclopentyl]enanthic acid Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C)(C)C(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)OC2CCCCO2

Isomeric SMILES

CC#CCC(C)(C)C(/C=C/C1C(CC(=O)C1CCCCCCC(=O)O)O)OC2CCCCO2

InChI

InChI=1S/C27H42O6/c1-4-5-17-27(2,3)24(33-26-14-10-11-18-32-26)16-15-21-20(22(28)19-23(21)29)12-8-6-7-9-13-25(30)31/h15-16,20-21,23-24,26,29H,6-14,17-19H2,1-3H3,(H,30,31)/b16-15+