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

Systemtic Name: [3-[2,3-bis(oxidanyl)propoxy-oxidanyl-phosphoryl]oxy-2-oxidanyl-propyl] hexanoate Openeye Name: [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxy-propyl] hexanoate CAS Name: hexanoic acid [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] ester IUPAC Name: [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] hexanoate Traditional Name: hexanoic acid [3-[glyceryloxy(hydroxy)phosphoryl]oxy-2-hydroxy-propyl] ester Formula: C12H25O9P MolecularWeight: 344.295261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25O9P/c1-2-3-4-5-12(16)19-7-11(15)9-21-22(17,18)20-8-10(14)6-13/h10-11,13-15H,2-9H2,1H3,(H,17,18)