[(2S)-2-[(2-nonadecanoyloxy-3-octadecanoyloxy-propyl)amino]-3-oxidanyl-3-oxidanylidene-propyl] hydrogen phosphate

Systemtic Name: [(2S)-2-[(2-nonadecanoyloxy-3-octadecanoyloxy-propyl)amino]-3-oxidanyl-3-oxidanylidene-propyl] hydrogen phosphate Openeye Name: [(2S)-3-hydroxy-2-[(2-nonadecanoyloxy-3-octadecanoyloxy-propyl)amino]-3-oxo-propyl] hydrogen phosphate CAS Name: [(2S)-3-hydroxy-3-oxo-2-[[2-(1-oxononadecoxy)-3-(1-oxooctadecoxy)propyl]amino]propyl] hydrogen phosphate IUPAC Name: [(2S)-3-hydroxy-2-[(2-nonadecanoyloxy-3-octadecanoyloxypropyl)amino]-3-oxopropyl] hydrogen phosphate Traditional Name: [(2S)-3-hydroxy-3-keto-2-[(2-nonadecanoyloxy-3-stearoyloxy-propyl)amino]propyl] hydrogen phosphate Formula: C43H83NO10P- MolecularWeight: 805.093581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=O)OC(CNC(COP(=O)(O)[O-])C(=O)O)COC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=O)OC(CN[C@@H](COP(=O)(O)[O-])C(=O)O)COC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C43H84NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-42(46)54-39(36-44-40(43(47)48)38-53-55(49,50)51)37-52-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39-40,44H,3-38H2,1-2H3,(H,47,48)(H2,49,50,51)/p-1/t39?,40-/m0/s1