[(1R,4R,5S)-4,5-bis(oxidanyl)-5-tridecanoyl-cyclopent-2-en-1-yl] ethanoate

Systemtic Name: [(1R,4R,5S)-4,5-bis(oxidanyl)-5-tridecanoyl-cyclopent-2-en-1-yl] ethanoate Openeye Name: [(1R,4R,5S)-4,5-dihydroxy-5-tridecanoyl-cyclopent-2-en-1-yl] acetate CAS Name: acetic acid [(1R,4R,5S)-4,5-dihydroxy-5-(1-oxotridecyl)-1-cyclopent-2-enyl] ester IUPAC Name: [(1R,4R,5S)-4,5-dihydroxy-5-tridecanoylcyclopent-2-en-1-yl] acetate Traditional Name: acetic acid [(1R,4R,5S)-4,5-dihydroxy-5-tridecanoyl-cyclopent-2-en-1-yl] ester Formula: C20H34O5 MolecularWeight: 354.48096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)C1(C(C=CC1OC(=O)C)O)O

Isomeric SMILES

CCCCCCCCCCCCC(=O)[C@@]1([C@@H](C=C[C@H]1OC(=O)C)O)O

InChI

InChI=1S/C20H34O5/c1-3-4-5-6-7-8-9-10-11-12-13-17(22)20(24)18(23)14-15-19(20)25-16(2)21/h14-15,18-19,23-24H,3-13H2,1-2H3/t18-,19-,20+/m1/s1