(E)-8-methyl-2-(oxan-2-yloxy)-9-oxidanyl-2-(oxolan-2-yl)pentadec-8-enoic acid

Systemtic Name: (E)-8-methyl-2-(oxan-2-yloxy)-9-oxidanyl-2-(oxolan-2-yl)pentadec-8-enoic acid Openeye Name: (E)-9-hydroxy-8-methyl-2-tetrahydrofuran-2-yl-2-tetrahydropyran-2-yloxy-pentadec-8-enoic acid CAS Name: (E)-9-hydroxy-8-methyl-2-(2-oxanyloxy)-2-(2-oxolanyl)-8-pentadecenoic acid IUPAC Name: (E)-9-hydroxy-8-methyl-2-(oxan-2-yloxy)-2-(oxolan-2-yl)pentadec-8-enoic acid Traditional Name: (E)-9-hydroxy-8-methyl-2-(tetrahydrofuryl)-2-tetrahydropyran-2-yloxy-pentadec-8-enoic acid Formula: C25H44O6 MolecularWeight: 440.61326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=C(C)CCCCCC(C1CCCO1)(C(=O)O)OC2CCCCO2)O

Isomeric SMILES

CCCCCC/C(=C(/C)\CCCCCC(C1CCCO1)(C(=O)O)OC2CCCCO2)/O

InChI

InChI=1S/C25H44O6/c1-3-4-5-8-14-21(26)20(2)13-7-6-10-17-25(24(27)28,22-15-12-19-29-22)31-23-16-9-11-18-30-23/h22-23,26H,3-19H2,1-2H3,(H,27,28)/b21-20+