7-[2-(3-methylbutanoyl)-4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]heptanoic acid

Systemtic Name: 7-[2-(3-methylbutanoyl)-4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]heptanoic acid Openeye Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(3-methylbutanoyl)cyclopenten-1-yl]heptanoic acid CAS Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(3-methyl-1-oxobutyl)-1-cyclopentenyl]heptanoic acid IUPAC Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(3-methylbutanoyl)cyclopenten-1-yl]heptanoic acid Traditional Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-isovaleryl-cyclopenten-1-yl]enanthic acid Formula: C25H42O5 MolecularWeight: 422.59798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H42O5/c1-4-5-8-11-19(26)14-15-21-20(12-9-6-7-10-13-25(29)30)22(17-24(21)28)23(27)16-18(2)3/h14-15,18-19,21,24,26,28H,4-13,16-17H2,1-3H3,(H,29,30)/b15-14+