[(2R,3S,4S)-3,4-bis(oxidanyl)-5-oxidanylidene-oxan-2-yl]methyl octanoate

Systemtic Name: [(2R,3S,4S)-3,4-bis(oxidanyl)-5-oxidanylidene-oxan-2-yl]methyl octanoate Openeye Name: [(2R,3S,4S)-3,4-dihydroxy-5-oxo-tetrahydropyran-2-yl]methyl octanoate CAS Name: octanoic acid [(2R,3S,4S)-3,4-dihydroxy-5-oxo-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S)-3,4-dihydroxy-5-oxooxan-2-yl]methyl octanoate Traditional Name: caprylic acid [(2R,3S,4S)-3,4-dihydroxy-5-keto-tetrahydropyran-2-yl]methyl ester Formula: C14H24O6 MolecularWeight: 288.33676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC1C(C(C(=O)CO1)O)O

Isomeric SMILES

CCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H](C(=O)CO1)O)O

InChI

InChI=1S/C14H24O6/c1-2-3-4-5-6-7-12(16)20-9-11-14(18)13(17)10(15)8-19-11/h11,13-14,17-18H,2-9H2,1H3/t11-,13-,14-/m1/s1