[1-heptanoylsulfanyl-3-[2-hydroxyethyloxy(oxidanyl)phosphoryl]oxy-propan-2-yl] heptanoate

Systemtic Name: [1-heptanoylsulfanyl-3-[2-hydroxyethyloxy(oxidanyl)phosphoryl]oxy-propan-2-yl] heptanoate Openeye Name: [1-(heptanoylsulfanylmethyl)-2-[hydroxy(2-hydroxyethoxy)phosphoryl]oxy-ethyl] heptanoate CAS Name: heptanoic acid [1-[hydroxy(2-hydroxyethoxy)phosphoryl]oxy-3-(1-oxoheptylthio)propan-2-yl] ester IUPAC Name: [1-heptanoylsulfanyl-3-[hydroxy(2-hydroxyethoxy)phosphoryl]oxypropan-2-yl] heptanoate Traditional Name: enanthic acid [1-[(enanthylthio)methyl]-2-[hydroxy(2-hydroxyethoxy)phosphoryl]oxy-ethyl] ester Formula: C19H37O8PS MolecularWeight: 456.531041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(COP(=O)(O)OCCO)CSC(=O)CCCCCC

Isomeric SMILES

CCCCCCC(=O)OC(COP(=O)(O)OCCO)CSC(=O)CCCCCC

InChI

InChI=1S/C19H37O8PS/c1-3-5-7-9-11-18(21)27-17(15-26-28(23,24)25-14-13-20)16-29-19(22)12-10-8-6-4-2/h17,20H,3-16H2,1-2H3,(H,23,24)