[3-octanoyloxy-4,5,6-tris(oxidanyl)-1-oxidanylidene-hexan-2-yl] octanoate

Systemtic Name: [3-octanoyloxy-4,5,6-tris(oxidanyl)-1-oxidanylidene-hexan-2-yl] octanoate Openeye Name: (1-formyl-3,4,5-trihydroxy-2-octanoyloxy-pentyl) octanoate CAS Name: octanoic acid [4,5,6-trihydroxy-1-oxo-3-(1-oxooctoxy)hexan-2-yl] ester IUPAC Name: (4,5,6-trihydroxy-3-octanoyloxy-1-oxohexan-2-yl) octanoate Traditional Name: caprylic acid (2-caprylyloxy-1-formyl-3,4,5-trihydroxy-pentyl) ester Formula: C22H40O8 MolecularWeight: 432.5482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(C=O)C(C(C(CO)O)O)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OC(C=O)C(C(C(CO)O)O)OC(=O)CCCCCCC

InChI

InChI=1S/C22H40O8/c1-3-5-7-9-11-13-19(26)29-18(16-24)22(21(28)17(25)15-23)30-20(27)14-12-10-8-6-4-2/h16-18,21-23,25,28H,3-15H2,1-2H3