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

Systemtic Name: [(2R,3S,4S)-3,4-bis(oxidanyl)-5-oxidanylidene-oxan-2-yl]methyl pentacosanoate Openeye Name: [(2R,3S,4S)-3,4-dihydroxy-5-oxo-tetrahydropyran-2-yl]methyl pentacosanoate CAS Name: pentacosanoic 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 pentacosanoate Traditional Name: pentacosanoic acid [(2R,3S,4S)-3,4-dihydroxy-5-keto-tetrahydropyran-2-yl]methyl ester Formula: C31H58O6 MolecularWeight: 526.78862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(=O)CO1)O)O

Isomeric SMILES

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

InChI

InChI=1S/C31H58O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29(33)37-26-28-31(35)30(34)27(32)25-36-28/h28,30-31,34-35H,2-26H2,1H3/t28-,30-,31-/m1/s1