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

Systemtic Name: [(2R,3S,4S)-3,4-bis(oxidanyl)-5-oxidanylidene-oxan-2-yl]methyl heptadecanoate Openeye Name: [(2R,3S,4S)-3,4-dihydroxy-5-oxo-tetrahydropyran-2-yl]methyl heptadecanoate CAS Name: heptadecanoic 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 heptadecanoate Traditional Name: heptadecanoic acid [(2R,3S,4S)-3,4-dihydroxy-5-keto-tetrahydropyran-2-yl]methyl ester Formula: C23H42O6 MolecularWeight: 414.57598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(=O)CO1)O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H42O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21(25)29-18-20-23(27)22(26)19(24)17-28-20/h20,22-23,26-27H,2-18H2,1H3/t20-,22-,23-/m1/s1