[(2S)-2-[(2R)-3,5-bis(oxidanylidene)-4-phosphonooxy-oxolan-2-yl]-2-oxidanyl-ethyl] hexadecanoate

Systemtic Name: [(2S)-2-[(2R)-3,5-bis(oxidanylidene)-4-phosphonooxy-oxolan-2-yl]-2-oxidanyl-ethyl] hexadecanoate Openeye Name: [(2S)-2-[(2R)-3,5-dioxo-4-phosphonooxy-tetrahydrofuran-2-yl]-2-hydroxy-ethyl] hexadecanoate CAS Name: hexadecanoic acid [(2S)-2-[(2R)-3,5-dioxo-4-phosphonooxy-2-oxolanyl]-2-hydroxyethyl] ester IUPAC Name: [(2S)-2-[(2R)-3,5-dioxo-4-phosphonooxyoxolan-2-yl]-2-hydroxyethyl] hexadecanoate Traditional Name: palmitic acid [(2S)-2-[(2R)-3,5-diketo-4-phosphonooxy-tetrahydrofuran-2-yl]-2-hydroxy-ethyl] ester Formula: C22H39O10P MolecularWeight: 494.512821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(C1C(=O)C(C(=O)O1)OP(=O)(O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@@H]([C@@H]1C(=O)C(C(=O)O1)OP(=O)(O)O)O

InChI

InChI=1S/C22H39O10P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)30-16-17(23)20-19(25)21(22(26)31-20)32-33(27,28)29/h17,20-21,23H,2-16H2,1H3,(H2,27,28,29)/t17-,20+,21?/m0/s1