7-[(1R,2S,3R)-2-(2-carboxyethyl)-3-ethanoyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1R,2S,3R)-2-(2-carboxyethyl)-3-ethanoyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2S,3R)-3-acetyl-2-(2-carboxyethyl)-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2S,3R)-3-acetyl-2-(2-carboxyethyl)-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2S,3R)-3-acetyl-2-(2-carboxyethyl)-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2S,3R)-3-acetyl-2-(2-carboxyethyl)-5-keto-cyclopentyl]enanthic acid Formula: C17H26O6 MolecularWeight: 326.38474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(=O)C(C1CCC(=O)O)CCCCCCC(=O)O

Isomeric SMILES

CC(=O)[C@@H]1CC(=O)[C@@H]([C@H]1CCC(=O)O)CCCCCCC(=O)O

InChI

InChI=1S/C17H26O6/c1-11(18)14-10-15(19)13(12(14)8-9-17(22)23)6-4-2-3-5-7-16(20)21/h12-14H,2-10H2,1H3,(H,20,21)(H,22,23)/t12-,13-,14+/m1/s1