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[(1S,3R)-3-hexadecylsulfanyl-1-oxidanyl-cyclohexyl] dihydrogen phosphate

Systemtic Name:	[(1S,3R)-3-hexadecylsulfanyl-1-oxidanyl-cyclohexyl] dihydrogen phosphate
Openeye Name:	[(1S,3R)-3-hexadecylsulfanyl-1-hydroxy-cyclohexyl] dihydrogen phosphate
CAS Name:	[(1S,3R)-3-(hexadecylthio)-1-hydroxycyclohexyl] dihydrogen phosphate
IUPAC Name:	[(1S,3R)-3-hexadecylsulfanyl-1-hydroxycyclohexyl] dihydrogen phosphate
Traditional Name:	[(1S,3R)-3-(cetylthio)-1-hydroxy-cyclohexyl] dihydrogen phosphate
Formula:	C₂₂H₄₅O₅PS
MolecularWeight:	452.628461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1CCCC(C1)(O)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCS[C@@H]1CCC[C@](C1)(O)OP(=O)(O)O

InChI

InChI=1S/C22H45O5PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-29-21-17-16-18-22(23,20-21)27-28(24,25)26/h21,23H,2-20H2,1H3,(H2,24,25,26)/t21-,22+/m1/s1

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