(E)-7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-5-keto-cyclopentyl]hept-5-enoic acid Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C)C(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H30O5/c1-3-4-9-15(2)18(22)13-12-17-16(19(23)14-20(17)24)10-7-5-6-8-11-21(25)26/h5,7,12-13,15-18,20,22,24H,6,8-11,14H2,1-2H3,(H,25,26)/b7-5+,13-12+