7-[3,5-diacetyloxy-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-en-6-ynyl]cyclopentyl]heptanoic acid

Systemtic Name: 7-[3,5-diacetyloxy-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-en-6-ynyl]cyclopentyl]heptanoic acid Openeye Name: 7-[3,5-diacetoxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-en-6-ynyl]cyclopentyl]heptanoic acid CAS Name: 7-[3,5-diacetyloxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-en-6-ynyl]cyclopentyl]heptanoic acid IUPAC Name: 7-[3,5-diacetyloxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-en-6-ynyl]cyclopentyl]heptanoic acid Traditional Name: 7-[3,5-diacetoxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-en-6-ynyl]cyclopentyl]enanthic acid Formula: C26H40O7 MolecularWeight: 464.5916

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C)(C)C(C=CC1C(CC(C1CCCCCCC(=O)O)OC(=O)C)OC(=O)C)O

Isomeric SMILES

CC#CCC(C)(C)C(/C=C/C1C(CC(C1CCCCCCC(=O)O)OC(=O)C)OC(=O)C)O

InChI

InChI=1S/C26H40O7/c1-6-7-16-26(4,5)24(29)15-14-21-20(12-10-8-9-11-13-25(30)31)22(32-18(2)27)17-23(21)33-19(3)28/h14-15,20-24,29H,8-13,16-17H2,1-5H3,(H,30,31)/b15-14+