methyl 7-[(3R,5S)-3-oxidanyl-2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoate

Systemtic Name: methyl 7-[(3R,5S)-3-oxidanyl-2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoate Openeye Name: methyl 7-[(3R,5S)-3-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-oxo-cyclopentyl]heptanoate CAS Name: 7-[(3R,5S)-3-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(3R,5S)-3-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-oxocyclopentyl]heptanoate Traditional Name: 7-[(3R,5S)-3-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-keto-cyclopentyl]enanthic acid methyl ester Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CC(C(=O)C1CCCCCCC(=O)OC)O)O

Isomeric SMILES

CCCCCC(/C=C/[C@@H]1C[C@H](C(=O)C1CCCCCCC(=O)OC)O)O

InChI

InChI=1S/C21H36O5/c1-3-4-7-10-17(22)14-13-16-15-19(23)21(25)18(16)11-8-5-6-9-12-20(24)26-2/h13-14,16-19,22-23H,3-12,15H2,1-2H3/b14-13+/t16-,17?,18?,19-/m1/s1