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

Systemtic Name: 7-[3,5-diacetyloxy-2-[(E)-3-methyl-3-oxidanyl-oct-1-en-6-ynyl]cyclopentyl]heptanoic acid Openeye Name: 7-[3,5-diacetoxy-2-[(E)-3-hydroxy-3-methyl-oct-1-en-6-ynyl]cyclopentyl]heptanoic acid CAS Name: 7-[3,5-diacetyloxy-2-[(E)-3-hydroxy-3-methyloct-1-en-6-ynyl]cyclopentyl]heptanoic acid IUPAC Name: 7-[3,5-diacetyloxy-2-[(E)-3-hydroxy-3-methyloct-1-en-6-ynyl]cyclopentyl]heptanoic acid Traditional Name: 7-[3,5-diacetoxy-2-[(E)-3-hydroxy-3-methyl-oct-1-en-6-ynyl]cyclopentyl]enanthic acid Formula: C25H38O7 MolecularWeight: 450.56502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38O7/c1-5-6-11-15-25(4,30)16-14-21-20(12-9-7-8-10-13-24(28)29)22(31-18(2)26)17-23(21)32-19(3)27/h14,16,20-23,30H,7-13,15,17H2,1-4H3,(H,28,29)/b16-14+