18-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-19-oxidanyl-icosanoic acid

Systemtic Name: 18-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-19-oxidanyl-icosanoic acid Openeye Name: 19-hydroxy-18-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-icosanoic acid CAS Name: 19-hydroxy-18-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]eicosanoic acid IUPAC Name: 19-hydroxy-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyicosanoic acid Traditional Name: 19-hydroxy-18-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-arachidic acid Formula: C26H50O9 MolecularWeight: 506.6698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCCCCCCCCCCCCCCC(=O)O)OC1C(C(C(C(O1)CO)O)O)O)O

Isomeric SMILES

CC(C(CCCCCCCCCCCCCCCCC(=O)O)OC1C(C(C(C(O1)CO)O)O)O)O

InChI

InChI=1S/C26H50O9/c1-19(28)20(34-26-25(33)24(32)23(31)21(18-27)35-26)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-22(29)30/h19-21,23-28,31-33H,2-18H2,1H3,(H,29,30)