[3-[2,3-bis(oxidanyl)propoxy-oxidanyl-phosphoryl]oxy-2-hexanoyloxy-propyl] hexanoate

Systemtic Name: [3-[2,3-bis(oxidanyl)propoxy-oxidanyl-phosphoryl]oxy-2-hexanoyloxy-propyl] hexanoate Openeye Name: [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hexanoyloxy-propyl] hexanoate CAS Name: hexanoic acid [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-(1-oxohexoxy)propyl] ester IUPAC Name: [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hexanoyloxypropyl] hexanoate Traditional Name: hexanoic acid [2-caproyloxy-3-[glyceryloxy(hydroxy)phosphoryl]oxy-propyl] ester Formula: C18H35O10P MolecularWeight: 442.438261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(COP(=O)(O)OCC(CO)O)OC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OCC(COP(=O)(O)OCC(CO)O)OC(=O)CCCCC

InChI

InChI=1S/C18H35O10P/c1-3-5-7-9-17(21)25-13-16(28-18(22)10-8-6-4-2)14-27-29(23,24)26-12-15(20)11-19/h15-16,19-20H,3-14H2,1-2H3,(H,23,24)