[(2S)-1-(2-hydroxyethyloxy)-3-phosphonooxy-propan-2-yl] (E)-octadec-9-enoate

Systemtic Name: [(2S)-1-(2-hydroxyethyloxy)-3-phosphonooxy-propan-2-yl] (E)-octadec-9-enoate Openeye Name: [(1S)-1-(2-hydroxyethoxymethyl)-2-phosphonooxy-ethyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [(2S)-1-(2-hydroxyethoxy)-3-phosphonooxypropan-2-yl] ester IUPAC Name: [(2S)-1-(2-hydroxyethoxy)-3-phosphonooxypropan-2-yl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [(1S)-1-(2-hydroxyethoxymethyl)-2-phosphonooxy-ethyl] ester Formula: C23H45O8P MolecularWeight: 480.572361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(COCCO)COP(=O)(O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)O[C@@H](COCCO)COP(=O)(O)O

InChI

InChI=1S/C23H45O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(25)31-22(20-29-19-18-24)21-30-32(26,27)28/h9-10,22,24H,2-8,11-21H2,1H3,(H2,26,27,28)/b10-9+/t22-/m0/s1