[6-(hydroxymethyl)-2-methyl-3,4,5-tris(oxidanyl)oxan-2-yl] octanoate

Systemtic Name: [6-(hydroxymethyl)-2-methyl-3,4,5-tris(oxidanyl)oxan-2-yl] octanoate Openeye Name: [3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-tetrahydropyran-2-yl] octanoate CAS Name: octanoic acid [3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyl-2-oxanyl] ester IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyloxan-2-yl] octanoate Traditional Name: caprylic acid (3,4,5-trihydroxy-2-methyl-6-methylol-tetrahydropyran-2-yl) ester Formula: C15H28O7 MolecularWeight: 320.37862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)C

Isomeric SMILES

CCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)C

InChI

InChI=1S/C15H28O7/c1-3-4-5-6-7-8-11(17)22-15(2)14(20)13(19)12(18)10(9-16)21-15/h10,12-14,16,18-20H,3-9H2,1-2H3