[2-[2,5-bis(hydroxymethyl)-3-octanoyloxy-4-oxidanyl-oxolan-2-yl]oxy-6-(hydroxymethyl)-3-octanoyloxy-5-oxidanyl-oxan-4-yl] octanoate

Systemtic Name: [2-[2,5-bis(hydroxymethyl)-3-octanoyloxy-4-oxidanyl-oxolan-2-yl]oxy-6-(hydroxymethyl)-3-octanoyloxy-5-oxidanyl-oxan-4-yl] octanoate Openeye Name: [5-hydroxy-2-[4-hydroxy-2,5-bis(hydroxymethyl)-3-octanoyloxy-tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)-3-octanoyloxy-tetrahydropyran-4-yl] octanoate CAS Name: octanoic acid [5-hydroxy-2-[[4-hydroxy-2,5-bis(hydroxymethyl)-3-(1-oxooctoxy)-2-oxolanyl]oxy]-6-(hydroxymethyl)-3-(1-oxooctoxy)-4-oxanyl] ester IUPAC Name: [5-hydroxy-2-[4-hydroxy-2,5-bis(hydroxymethyl)-3-octanoyloxyoxolan-2-yl]oxy-6-(hydroxymethyl)-3-octanoyloxyoxan-4-yl] octanoate Traditional Name: caprylic acid [3-caprylyloxy-2-(3-caprylyloxy-4-hydroxy-2,5-dimethylol-tetrahydrofuran-2-yl)oxy-5-hydroxy-6-methylol-tetrahydropyran-4-yl] ester Formula: C36H64O14 MolecularWeight: 720.88496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1C(C(OC(C1OC(=O)CCCCCCC)OC2(C(C(C(O2)CO)O)OC(=O)CCCCCCC)CO)CO)O

Isomeric SMILES

CCCCCCCC(=O)OC1C(C(OC(C1OC(=O)CCCCCCC)OC2(C(C(C(O2)CO)O)OC(=O)CCCCCCC)CO)CO)O

InChI

InChI=1S/C36H64O14/c1-4-7-10-13-16-19-27(40)46-32-30(43)25(22-37)45-35(33(32)47-28(41)20-17-14-11-8-5-2)50-36(24-39)34(31(44)26(23-38)49-36)48-29(42)21-18-15-12-9-6-3/h25-26,30-35,37-39,43-44H,4-24H2,1-3H3