disodium [(2R)-3-(12-azanyldodecanoyloxy)-2-dodecanoyloxy-propyl] phosphate

Systemtic Name: disodium [(2R)-3-(12-azanyldodecanoyloxy)-2-dodecanoyloxy-propyl] phosphate Openeye Name: disodium [(2R)-3-(12-aminododecanoyloxy)-2-dodecanoyloxy-propyl] phosphate CAS Name: disodium [(2R)-3-(12-amino-1-oxododecoxy)-2-(1-oxododecoxy)propyl] phosphate IUPAC Name: disodium [(2R)-3-(12-aminododecanoyloxy)-2-dodecanoyloxypropyl] phosphate Traditional Name: disodium [(2R)-3-(12-aminododecanoyloxy)-2-lauroyloxy-propyl] phosphate Formula: C27H52NNa2O8P MolecularWeight: 595.656981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCN)COP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCN)COP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C27H54NO8P.2Na/c1-2-3-4-5-6-8-12-15-18-21-27(30)36-25(24-35-37(31,32)33)23-34-26(29)20-17-14-11-9-7-10-13-16-19-22-28;;/h25H,2-24,28H2,1H3,(H2,31,32,33);;/q;2*+1/p-2/t25-;;/m1../s1