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

Systemtic Name: 7-[4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]-2-phenethyl-cyclopenten-1-yl]heptanoic acid Openeye Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-phenethyl-cyclopenten-1-yl]heptanoic acid CAS Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-phenethyl-1-cyclopentenyl]heptanoic acid IUPAC Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-phenethylcyclopenten-1-yl]heptanoic acid Traditional Name: 7-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-phenethyl-cyclopenten-1-yl]enanthic acid Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(=C1CCCCCCC(=O)O)CCC2=CC=CC=C2)O)O

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(=C1CCCCCCC(=O)O)CCC2=CC=CC=C2)O)O

InChI

InChI=1S/C28H42O4/c1-2-3-7-14-24(29)19-20-26-25(15-10-4-5-11-16-28(31)32)23(21-27(26)30)18-17-22-12-8-6-9-13-22/h6,8-9,12-13,19-20,24,26-27,29-30H,2-5,7,10-11,14-18,21H2,1H3,(H,31,32)/b20-19+