(E)-N-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-octadecyl-octadec-9-enamide

Systemtic Name: (E)-N-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-octadecyl-octadec-9-enamide Openeye Name: (E)-N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-N-octadecyl-octadec-9-enamide CAS Name: (E)-N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]-N-octadecyl-9-octadecenamide IUPAC Name: (E)-N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-N-octadecyloctadec-9-enamide Traditional Name: (E)-N-(3-acetamido-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)-N-stearyl-octadec-9-enamide Formula: C44H84N2O6 MolecularWeight: 737.14756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)C)C(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)C)C(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H84N2O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-46(44-41(45-38(3)48)43(51)42(50)39(37-47)52-44)40(49)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h19,21,39,41-44,47,50-51H,4-18,20,22-37H2,1-3H3,(H,45,48)/b21-19+