3-[(2-decoxy-3-decylsulfanyl-propoxy)-oxidanyl-phosphoryl]propanoic acid

Systemtic Name: 3-[(2-decoxy-3-decylsulfanyl-propoxy)-oxidanyl-phosphoryl]propanoic acid Openeye Name: 3-[(2-decoxy-3-decylsulfanyl-propoxy)-hydroxy-phosphoryl]propanoic acid CAS Name: 3-[[2-decoxy-3-(decylthio)propoxy]-hydroxyphosphoryl]propanoic acid IUPAC Name: 3-[(2-decoxy-3-decylsulfanylpropoxy)-hydroxyphosphoryl]propanoic acid Traditional Name: 3-[[2-decoxy-3-(decylthio)propoxy]-hydroxy-phosphoryl]propionic acid Formula: C26H53O6PS MolecularWeight: 524.734181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(COP(=O)(CCC(=O)O)O)CSCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC(COP(=O)(CCC(=O)O)O)CSCCCCCCCCCC

InChI

InChI=1S/C26H53O6PS/c1-3-5-7-9-11-13-15-17-20-31-25(23-32-33(29,30)21-19-26(27)28)24-34-22-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2H3,(H,27,28)(H,29,30)