[6-(hydroxymethyl)-4,5-bis(oxidanyl)-3-(tetradecanoylamino)oxan-2-yl] 14-phenylmethoxytetradecanoate

Systemtic Name: [6-(hydroxymethyl)-4,5-bis(oxidanyl)-3-(tetradecanoylamino)oxan-2-yl] 14-phenylmethoxytetradecanoate Openeye Name: [4,5-dihydroxy-6-(hydroxymethyl)-3-(tetradecanoylamino)tetrahydropyran-2-yl] 14-benzyloxytetradecanoate CAS Name: 14-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] 14-phenylmethoxytetradecanoate Traditional Name: 14-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)CCCCCCCCCCCCCOCC2=CC=CC=C2)CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC1C(C(C(OC1OC(=O)CCCCCCCCCCCCCOCC2=CC=CC=C2)CO)O)O

InChI

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