(E)-7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-methyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-methyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-3-methyl-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-3-methyl-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-3-methyl-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-keto-3-methyl-cyclopentyl]hept-5-enoic acid Formula: C23H38O4 MolecularWeight: 378.54542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)C)O

Isomeric SMILES

CCCCC(C)(C)C(/C=C/C1C(CC(=O)C1C/C=C/CCCC(=O)O)C)O

InChI

InChI=1S/C23H38O4/c1-5-6-15-23(3,4)21(25)14-13-18-17(2)16-20(24)19(18)11-9-7-8-10-12-22(26)27/h7,9,13-14,17-19,21,25H,5-6,8,10-12,15-16H2,1-4H3,(H,26,27)/b9-7+,14-13+