[(2S)-2-(octadecanoylamino)-3-phenoxy-propyl] dihydrogen phosphate

Systemtic Name: [(2S)-2-(octadecanoylamino)-3-phenoxy-propyl] dihydrogen phosphate Openeye Name: [(2S)-2-(octadecanoylamino)-3-phenoxy-propyl] dihydrogen phosphate CAS Name: [(2S)-2-(1-oxooctadecylamino)-3-phenoxypropyl] dihydrogen phosphate IUPAC Name: [(2S)-2-(octadecanoylamino)-3-phenoxypropyl] dihydrogen phosphate Traditional Name: [(2S)-3-phenoxy-2-stearamido-propyl] dihydrogen phosphate Formula: C27H48NO6P MolecularWeight: 513.646881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(COC1=CC=CC=C1)COP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](COC1=CC=CC=C1)COP(=O)(O)O

InChI

InChI=1S/C27H48NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-27(29)28-25(24-34-35(30,31)32)23-33-26-20-17-16-18-21-26/h16-18,20-21,25H,2-15,19,22-24H2,1H3,(H,28,29)(H2,30,31,32)/t25-/m0/s1