[6-(hydroxymethyl)-4,5-bis(oxidanyl)-3-(tetradecanoylamino)oxan-2-yl] 3-phenylmethoxytetradecanoate

Systemtic Name: [6-(hydroxymethyl)-4,5-bis(oxidanyl)-3-(tetradecanoylamino)oxan-2-yl] 3-phenylmethoxytetradecanoate Openeye Name: [4,5-dihydroxy-6-(hydroxymethyl)-3-(tetradecanoylamino)tetrahydropyran-2-yl] 3-benzyloxytetradecanoate CAS Name: 3-phenylmethoxytetradecanoic acid [4,5-dihydroxy-6-(hydroxymethyl)-3-(1-oxotetradecylamino)-2-oxanyl] ester IUPAC Name: [4,5-dihydroxy-6-(hydroxymethyl)-3-(tetradecanoylamino)oxan-2-yl] 3-phenylmethoxytetradecanoate Traditional Name: 3-benzoxymyristic acid [4,5-dihydroxy-6-methylol-3-(tetradecanoylamino)tetrahydropyran-2-yl] ester Formula: C41H71NO8 MolecularWeight: 706.00434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC1C(C(C(OC1OC(=O)CC(CCCCCCCCCCC)OCC2=CC=CC=C2)CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC1C(C(C(OC1OC(=O)CC(CCCCCCCCCCC)OCC2=CC=CC=C2)CO)O)O

InChI

InChI=1S/C41H71NO8/c1-3-5-7-9-11-13-14-16-18-20-25-29-36(44)42-38-40(47)39(46)35(31-43)49-41(38)50-37(45)30-34(48-32-33-26-22-21-23-27-33)28-24-19-17-15-12-10-8-6-4-2/h21-23,26-27,34-35,38-41,43,46-47H,3-20,24-25,28-32H2,1-2H3,(H,42,44)