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

Systemtic Name: 2-[[(2S)-2-methoxy-1-octadecoxy-3-oxidanyl-propyl]sulfanyloxy-oxidanyl-phosphoryl]ethanoic acid Openeye Name: 2-[hydroxy-[(2S)-3-hydroxy-2-methoxy-1-octadecoxy-propyl]sulfanyloxy-phosphoryl]acetic acid CAS Name: 2-[hydroxy-[[(2S)-3-hydroxy-2-methoxy-1-octadecoxypropyl]thio]oxyphosphoryl]acetic acid IUPAC Name: 2-[hydroxy-[(2S)-3-hydroxy-2-methoxy-1-octadecoxypropyl]sulfanyloxyphosphoryl]acetic acid Traditional Name: 2-[hydroxy-[[(2S)-3-hydroxy-2-methoxy-1-stearyloxy-propyl]thio]oxy-phosphoryl]acetic acid Formula: C24H49O8PS MolecularWeight: 528.679821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C(CO)OC)SOP(=O)(CC(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC([C@H](CO)OC)SOP(=O)(CC(=O)O)O

InChI

InChI=1S/C24H49O8PS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-31-24(22(20-25)30-2)34-32-33(28,29)21-23(26)27/h22,24-25H,3-21H2,1-2H3,(H,26,27)(H,28,29)/t22-,24?/m0/s1