3-acetamido-2-(1-fluoranyl-3-octadecanoyloxy-2-octadec-1-en-2-ylperoxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-2-(1-fluoranyl-3-octadecanoyloxy-2-octadec-1-en-2-ylperoxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-[1-fluoro-2-(1-methyleneheptadecylperoxy)-3-octadecanoyloxy-propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[1-fluoro-2-octadec-1-en-2-yldioxy-3-(1-oxooctadecoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(1-fluoro-3-octadecanoyloxy-2-octadec-1-en-2-ylperoxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-[2-(1-cetylvinylperoxy)-1-fluoro-3-stearoyloxy-propyl]-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C48H85FN2O8 MolecularWeight: 837.195503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)OOC(=C)CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)OOC(=C)CCCCCCCCCCCCCCCC

InChI

InChI=1S/C48H85FN2O8/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-44(53)56-38-43(45(49)47-46(51-40(4)52)41(37-50)36-42(57-47)48(54)55)59-58-39(3)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h36-37,41,43,45-47,50H,3,5-35,38H2,1-2,4H3,(H,51,52)(H,54,55)