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

Systemtic Name: [(2R,3S,4S)-3,4-bis(oxidanyl)-5-oxidanylidene-oxan-2-yl]methyl hexacosanoate Openeye Name: [(2R,3S,4S)-3,4-dihydroxy-5-oxo-tetrahydropyran-2-yl]methyl hexacosanoate CAS Name: hexacosanoic 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 hexacosanoate Traditional Name: cerotic acid [(2R,3S,4S)-3,4-dihydroxy-5-keto-tetrahydropyran-2-yl]methyl ester Formula: C32H60O6 MolecularWeight: 540.8152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(=O)CO1)O)O

Isomeric SMILES

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

InChI

InChI=1S/C32H60O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-30(34)38-27-29-32(36)31(35)28(33)26-37-29/h29,31-32,35-36H,2-27H2,1H3/t29-,31-,32-/m1/s1