(E)-7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyl-4-(4-oxidanyl-3-propyl-phenyl)but-1-enyl]cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyl-4-(4-oxidanyl-3-propyl-phenyl)but-1-enyl]cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-(4-hydroxy-3-propyl-phenyl)but-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-(4-hydroxy-3-propylphenyl)but-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-(4-hydroxy-3-propylphenyl)but-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-(4-hydroxy-3-propyl-phenyl)but-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid Formula: C25H34O6 MolecularWeight: 430.53386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)CC(C=CC2C(CC(=O)C2CC=CCCCC(=O)O)O)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)CC(/C=C/C2C(CC(=O)C2C/C=C/CCCC(=O)O)O)O)O

InChI

InChI=1S/C25H34O6/c1-2-7-18-14-17(10-13-22(18)27)15-19(26)11-12-21-20(23(28)16-24(21)29)8-5-3-4-6-9-25(30)31/h3,5,10-14,19-21,24,26-27,29H,2,4,6-9,15-16H2,1H3,(H,30,31)/b5-3+,12-11+