[3,4,5-tris(oxidanyl)oxan-2-yl]methyl docosanoate

Systemtic Name: [3,4,5-tris(oxidanyl)oxan-2-yl]methyl docosanoate Openeye Name: (3,4,5-trihydroxytetrahydropyran-2-yl)methyl docosanoate CAS Name: docosanoic acid (3,4,5-trihydroxy-2-oxanyl)methyl ester IUPAC Name: (3,4,5-trihydroxyoxan-2-yl)methyl docosanoate Traditional Name: behenic acid (3,4,5-trihydroxytetrahydropyran-2-yl)methyl ester Formula: C28H54O6 MolecularWeight: 486.72476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(CO1)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(CO1)O)O)O

InChI

InChI=1S/C28H54O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(30)34-23-25-28(32)27(31)24(29)22-33-25/h24-25,27-29,31-32H,2-23H2,1H3