7-[2-[(E)-3-methyl-3-oxidanyl-oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-3-methyl-3-oxidanyl-oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-3-methyl-oct-1-en-6-ynyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-3-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-3-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-3-methyl-oct-1-en-6-ynyl]-5-keto-cyclopentyl]enanthic acid Formula: C21H32O5 MolecularWeight: 364.47578

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC(C)(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CC#CCCC(C)(/C=C/C1C(CC(=O)C1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C21H32O5/c1-3-4-9-13-21(2,26)14-12-17-16(18(22)15-19(17)23)10-7-5-6-8-11-20(24)25/h12,14,16-17,19,23,26H,5-11,13,15H2,1-2H3,(H,24,25)/b14-12+