2-[(1R,2R,3R)-2-[(E)-3-ethynyl-3-oxidanyl-oct-1-enyl]-3-methyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 2-[(1R,2R,3R)-2-[(E)-3-ethynyl-3-oxidanyl-oct-1-enyl]-3-methyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 2-[(1R,2R,3R)-2-[(E)-3-ethynyl-3-hydroxy-oct-1-enyl]-3-methyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 2-[(1R,2R,3R)-2-[(E)-3-ethynyl-3-hydroxyoct-1-enyl]-3-methyl-5-oxocyclopentyl]heptanoic acid IUPAC Name: 2-[(1R,2R,3R)-2-[(E)-3-ethynyl-3-hydroxyoct-1-enyl]-3-methyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 2-[(1R,2R,3R)-2-[(E)-3-amyl-3-hydroxy-pent-1-en-4-ynyl]-5-keto-3-methyl-cyclopentyl]enanthic acid Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1C(C(CC1=O)C)C=CC(CCCCC)(C#C)O)C(=O)O

Isomeric SMILES

CCCCCC([C@H]1[C@H]([C@@H](CC1=O)C)/C=C/C(CCCCC)(C#C)O)C(=O)O

InChI

InChI=1S/C23H36O4/c1-5-8-10-12-19(22(25)26)21-18(17(4)16-20(21)24)13-15-23(27,7-3)14-11-9-6-2/h3,13,15,17-19,21,27H,5-6,8-12,14,16H2,1-2,4H3,(H,25,26)/b15-13+/t17-,18+,19?,21-,23?/m1/s1