7-[3-(hydroxymethyl)-5-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoic acid

Systemtic Name: 7-[3-(hydroxymethyl)-5-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoic acid Openeye Name: 7-[3-(hydroxymethyl)-2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[3-(hydroxymethyl)-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[3-(hydroxymethyl)-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-3-methylol-cyclopentyl]enanthic acid Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(=O)C1CCCCCCC(=O)O)CO)O

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(=O)C1CCCCCCC(=O)O)CO)O

InChI

InChI=1S/C21H36O5/c1-2-3-6-9-17(23)12-13-18-16(15-22)14-20(24)19(18)10-7-4-5-8-11-21(25)26/h12-13,16-19,22-23H,2-11,14-15H2,1H3,(H,25,26)/b13-12+