2-dimethylaminoethyl [(2R)-2-(octadecanoylamino)-3-oxidanyl-propyl] hydrogen phosphate

Systemtic Name: 2-dimethylaminoethyl [(2R)-2-(octadecanoylamino)-3-oxidanyl-propyl] hydrogen phosphate Openeye Name: 2-dimethylaminoethyl [(2R)-3-hydroxy-2-(octadecanoylamino)propyl] hydrogen phosphate CAS Name: 2-dimethylaminoethyl [(2R)-3-hydroxy-2-(1-oxooctadecylamino)propyl] hydrogen phosphate IUPAC Name: 2-dimethylaminoethyl [(2R)-3-hydroxy-2-(octadecanoylamino)propyl] hydrogen phosphate Traditional Name: 2-dimethylaminoethyl [(2R)-3-hydroxy-2-stearamido-propyl] hydrogen phosphate Formula: C25H53N2O6P MolecularWeight: 508.671881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CO)COP(=O)(O)OCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@H](CO)COP(=O)(O)OCCN(C)C

InChI

InChI=1S/C25H53N2O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(29)26-24(22-28)23-33-34(30,31)32-21-20-27(2)3/h24,28H,4-23H2,1-3H3,(H,26,29)(H,30,31)/t24-/m1/s1