S-[(2S)-3-[methoxy(oxidanyl)phosphoryl]oxy-2-octanoylsulfanyl-propyl] octanethioate

Systemtic Name: S-[(2S)-3-[methoxy(oxidanyl)phosphoryl]oxy-2-octanoylsulfanyl-propyl] octanethioate Openeye Name: S-[(2S)-3-[hydroxy(methoxy)phosphoryl]oxy-2-octanoylsulfanyl-propyl] octanethioate CAS Name: octanethioic acid S-[(2S)-3-[hydroxy(methoxy)phosphoryl]oxy-2-(1-oxooctylthio)propyl] ester IUPAC Name: S-[(2S)-3-[hydroxy(methoxy)phosphoryl]oxy-2-octanoylsulfanylpropyl] octanethioate Traditional Name: octanethioic acid S-[(2S)-2-(caprylylthio)-3-[hydroxy(methoxy)phosphoryl]oxy-propyl] ester Formula: C20H39O6PS2 MolecularWeight: 470.623821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)SCC(COP(=O)(O)OC)SC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)SC[C@H](COP(=O)(O)OC)SC(=O)CCCCCCC

InChI

InChI=1S/C20H39O6PS2/c1-4-6-8-10-12-14-19(21)28-17-18(16-26-27(23,24)25-3)29-20(22)15-13-11-9-7-5-2/h18H,4-17H2,1-3H3,(H,23,24)/t18-/m0/s1