[5-diphenylphosphoryloxy-3,4-bis(oxidanyl)-6-(phenylmethoxycarbonyloxymethyl)oxan-2-yl] 3-tetradecanoyloxytetradecanoate

Systemtic Name: [5-diphenylphosphoryloxy-3,4-bis(oxidanyl)-6-(phenylmethoxycarbonyloxymethyl)oxan-2-yl] 3-tetradecanoyloxytetradecanoate Openeye Name: [6-(benzyloxycarbonyloxymethyl)-5-diphenylphosphoryloxy-3,4-dihydroxy-tetrahydropyran-2-yl] 3-tetradecanoyloxytetradecanoate CAS Name: 3-(1-oxotetradecoxy)tetradecanoic acid [5-diphenylphosphoryloxy-3,4-dihydroxy-6-(phenylmethoxycarbonyloxymethyl)-2-oxanyl] ester IUPAC Name: [5-diphenylphosphoryloxy-3,4-dihydroxy-6-(phenylmethoxycarbonyloxymethyl)oxan-2-yl] 3-tetradecanoyloxytetradecanoate Traditional Name: 3-tetradecanoyloxymyristic acid [6-(carbobenzoxyoxymethyl)-5-diphenylphosphoryloxy-3,4-dihydroxy-tetrahydropyran-2-yl] ester Formula: C54H79O12P MolecularWeight: 951.171621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(C(C(C(O1)COC(=O)OCC2=CC=CC=C2)OP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(C(C(C(O1)COC(=O)OCC2=CC=CC=C2)OP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O)O

InChI

InChI=1S/C54H79O12P/c1-3-5-7-9-11-13-14-16-18-20-31-39-48(55)63-44(34-26-19-17-15-12-10-8-6-4-2)40-49(56)65-53-51(58)50(57)52(47(64-53)42-62-54(59)61-41-43-32-24-21-25-33-43)66-67(60,45-35-27-22-28-36-45)46-37-29-23-30-38-46/h21-25,27-30,32-33,35-38,44,47,50-53,57-58H,3-20,26,31,34,39-42H2,1-2H3