[5-[(2-fluoranyl-3-tetradecanoyloxy-tetradecanoyl)amino]-3-oxidanyl-2-(phenylmethoxymethoxymethyl)-6-prop-2-enoxy-oxan-4-yl] 3-phenylmethoxytetradecanoate

Systemtic Name: [5-[(2-fluoranyl-3-tetradecanoyloxy-tetradecanoyl)amino]-3-oxidanyl-2-(phenylmethoxymethoxymethyl)-6-prop-2-enoxy-oxan-4-yl] 3-phenylmethoxytetradecanoate Openeye Name: [2-allyloxy-6-(benzyloxymethoxymethyl)-3-[(2-fluoro-3-tetradecanoyloxy-tetradecanoyl)amino]-5-hydroxy-tetrahydropyran-4-yl] 3-benzyloxytetradecanoate CAS Name: 3-phenylmethoxytetradecanoic acid [5-[[2-fluoro-1-oxo-3-(1-oxotetradecoxy)tetradecyl]amino]-3-hydroxy-2-(phenylmethoxymethoxymethyl)-6-prop-2-enoxy-4-oxanyl] ester IUPAC Name: [5-[(2-fluoro-3-tetradecanoyloxytetradecanoyl)amino]-3-hydroxy-2-(phenylmethoxymethoxymethyl)-6-prop-2-enoxyoxan-4-yl] 3-phenylmethoxytetradecanoate Traditional Name: 3-benzoxymyristic acid [2-allyloxy-6-(benzoxymethoxymethyl)-3-[(2-fluoro-3-tetradecanoyloxy-tetradecanoyl)amino]-5-hydroxy-tetrahydropyran-4-yl] ester Formula: C66H108FNO11 MolecularWeight: 1110.562223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)C(C(=O)NC1C(C(C(OC1OCC=C)COCOCC2=CC=CC=C2)O)OC(=O)CC(CCCCCCCCCCC)OCC3=CC=CC=C3)F

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)C(C(=O)NC1C(C(C(OC1OCC=C)COCOCC2=CC=CC=C2)O)OC(=O)CC(CCCCCCCCCCC)OCC3=CC=CC=C3)F

InChI

InChI=1S/C66H108FNO11/c1-5-9-12-15-18-21-22-25-28-31-40-47-59(69)77-57(46-39-30-27-24-20-17-14-11-7-3)61(67)65(72)68-62-64(63(71)58(78-66(62)75-48-8-4)52-74-53-73-50-54-41-34-32-35-42-54)79-60(70)49-56(76-51-55-43-36-33-37-44-55)45-38-29-26-23-19-16-13-10-6-2/h8,32-37,41-44,56-58,61-64,66,71H,4-7,9-31,38-40,45-53H2,1-3H3,(H,68,72)