(1-octadecoxy-3-phosphonooxy-propan-2-yl) dihydrogen phosphate

Systemtic Name: (1-octadecoxy-3-phosphonooxy-propan-2-yl) dihydrogen phosphate Openeye Name: [1-(octadecoxymethyl)-2-phosphonooxy-ethyl] dihydrogen phosphate CAS Name: (1-octadecoxy-3-phosphonooxypropan-2-yl) dihydrogen phosphate IUPAC Name: (1-octadecoxy-3-phosphonooxypropan-2-yl) dihydrogen phosphate Traditional Name: [1-(phosphonooxymethyl)-2-stearyloxy-ethyl] dihydrogen phosphate Formula: C21H46O9P2 MolecularWeight: 504.532062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C21H46O9P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-19-21(30-32(25,26)27)20-29-31(22,23)24/h21H,2-20H2,1H3,(H2,22,23,24)(H2,25,26,27)