5-acetamido-6-octadecoxy-3,4-bis(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: 5-acetamido-6-octadecoxy-3,4-bis(oxidanyl)oxane-2-carboxylic acid Openeye Name: 5-acetamido-3,4-dihydroxy-6-octadecoxy-tetrahydropyran-2-carboxylic acid CAS Name: 5-acetamido-3,4-dihydroxy-6-octadecoxy-2-oxanecarboxylic acid IUPAC Name: 5-acetamido-3,4-dihydroxy-6-octadecoxyoxane-2-carboxylic acid Traditional Name: 5-acetamido-3,4-dihydroxy-6-stearyloxy-tetrahydropyran-2-carboxylic acid Formula: C26H49NO7 MolecularWeight: 487.66976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1C(C(C(C(O1)C(=O)O)O)O)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1C(C(C(C(O1)C(=O)O)O)O)NC(=O)C

InChI

InChI=1S/C26H49NO7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-33-26-21(27-20(2)28)22(29)23(30)24(34-26)25(31)32/h21-24,26,29-30H,3-19H2,1-2H3,(H,27,28)(H,31,32)