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

Systemtic Name: (E)-7-[2-[(E)-1-acetyloxy-4,4-dimethyl-oct-2-enyl]-3-methyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(E)-1-acetoxy-4,4-dimethyl-oct-2-enyl]-3-methyl-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[2-[(E)-1-acetyloxy-4,4-dimethyloct-2-enyl]-3-methyl-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-1-acetyloxy-4,4-dimethyloct-2-enyl]-3-methyl-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(E)-1-acetoxy-4,4-dimethyl-oct-2-enyl]-5-keto-3-methyl-cyclopentyl]hept-5-enoic acid Formula: C25H40O5 MolecularWeight: 420.5821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C=CC(C1C(CC(=O)C1CC=CCCCC(=O)O)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C25H40O5/c1-6-7-15-25(4,5)16-14-22(30-19(3)26)24-18(2)17-21(27)20(24)12-10-8-9-11-13-23(28)29/h8,10,14,16,18,20,22,24H,6-7,9,11-13,15,17H2,1-5H3,(H,28,29)/b10-8+,16-14+