7-[(1R,2R)-2-[(E)-3-acetyloxyoct-1-enyl]-5-oxidanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1R,2R)-2-[(E)-3-acetyloxyoct-1-enyl]-5-oxidanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2R)-2-[(E)-3-acetoxyoct-1-enyl]-5-hydroxy-cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2R)-2-[(E)-3-acetyloxyoct-1-enyl]-5-hydroxycyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2R)-2-[(E)-3-acetyloxyoct-1-enyl]-5-hydroxycyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2R)-2-[(E)-3-acetoxyoct-1-enyl]-5-hydroxy-cyclopentyl]enanthic acid Formula: C22H38O5 MolecularWeight: 382.53412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(C1CCCCCCC(=O)O)O)OC(=O)C

Isomeric SMILES

CCCCCC(/C=C/[C@H]1CCC([C@@H]1CCCCCCC(=O)O)O)OC(=O)C

InChI

InChI=1S/C22H38O5/c1-3-4-7-10-19(27-17(2)23)15-13-18-14-16-21(24)20(18)11-8-5-6-9-12-22(25)26/h13,15,18-21,24H,3-12,14,16H2,1-2H3,(H,25,26)/b15-13+/t18-,19?,20+,21?/m0/s1