5-acetyloxy-5-[2-[(1E,3E)-5-acetyloxytrideca-1,3-dienyl]cyclopentyl]pentanoic acid

Systemtic Name: 5-acetyloxy-5-[2-[(1E,3E)-5-acetyloxytrideca-1,3-dienyl]cyclopentyl]pentanoic acid Openeye Name: 5-acetoxy-5-[2-[(1E,3E)-5-acetoxytrideca-1,3-dienyl]cyclopentyl]pentanoic acid CAS Name: 5-acetyloxy-5-[2-[(1E,3E)-5-acetyloxytrideca-1,3-dienyl]cyclopentyl]pentanoic acid IUPAC Name: 5-acetyloxy-5-[2-[(1E,3E)-5-acetyloxytrideca-1,3-dienyl]cyclopentyl]pentanoic acid Traditional Name: 5-acetoxy-5-[2-[(1E,3E)-5-acetoxytrideca-1,3-dienyl]cyclopentyl]valeric acid Formula: C27H44O6 MolecularWeight: 464.63466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1CCCC1C(CCCC(=O)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C1CCCC1C(CCCC(=O)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C27H44O6/c1-4-5-6-7-8-9-16-24(32-21(2)28)17-11-10-14-23-15-12-18-25(23)26(33-22(3)29)19-13-20-27(30)31/h10-11,14,17,23-26H,4-9,12-13,15-16,18-20H2,1-3H3,(H,30,31)/b14-10+,17-11+