2-[(3-octadecoxy-1-oxidanyl-propyl)sulfanyloxy-oxidanyl-phosphoryl]ethanoic acid

Systemtic Name: 2-[(3-octadecoxy-1-oxidanyl-propyl)sulfanyloxy-oxidanyl-phosphoryl]ethanoic acid Openeye Name: 2-[hydroxy-(1-hydroxy-3-octadecoxy-propyl)sulfanyloxy-phosphoryl]acetic acid CAS Name: 2-[hydroxy-[(1-hydroxy-3-octadecoxypropyl)thio]oxyphosphoryl]acetic acid IUPAC Name: 2-[hydroxy-(1-hydroxy-3-octadecoxypropyl)sulfanyloxyphosphoryl]acetic acid Traditional Name: 2-[hydroxy-[(1-hydroxy-3-stearyloxy-propyl)thio]oxy-phosphoryl]acetic acid Formula: C23H47O7PS MolecularWeight: 498.653841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCC(O)SOP(=O)(CC(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCC(O)SOP(=O)(CC(=O)O)O

InChI

InChI=1S/C23H47O7PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-29-20-18-23(26)32-30-31(27,28)21-22(24)25/h23,26H,2-21H2,1H3,(H,24,25)(H,27,28)