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

Systemtic Name: (E)-7-[2-[(1E)-4-methyl-4-oxidanyl-octa-1,7-dienyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-hydroxy-2-[(1E)-4-hydroxy-4-methyl-octa-1,7-dienyl]-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-hydroxy-2-[(1E)-4-hydroxy-4-methylocta-1,7-dienyl]-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-hydroxy-2-[(1E)-4-hydroxy-4-methylocta-1,7-dienyl]-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-hydroxy-2-[(1E)-4-hydroxy-4-methyl-octa-1,7-dienyl]-5-keto-cyclopentyl]hept-5-enoic acid Formula: C21H32O5 MolecularWeight: 364.47578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O5/c1-3-4-13-21(2,26)14-9-11-17-16(18(22)15-19(17)23)10-7-5-6-8-12-20(24)25/h3,5,7,9,11,16-17,19,23,26H,1,4,6,8,10,12-15H2,2H3,(H,24,25)/b7-5+,11-9+