methyl 12-[6-(hydroxymethyl)-3,5-bis(oxidanyl)-4-phenylmethoxy-oxan-2-yl]oxydodecanoate

Systemtic Name: methyl 12-[6-(hydroxymethyl)-3,5-bis(oxidanyl)-4-phenylmethoxy-oxan-2-yl]oxydodecanoate Openeye Name: methyl 12-[4-benzyloxy-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxydodecanoate CAS Name: 12-[[3,5-dihydroxy-6-(hydroxymethyl)-4-phenylmethoxy-2-oxanyl]oxy]dodecanoic acid methyl ester IUPAC Name: methyl 12-[3,5-dihydroxy-6-(hydroxymethyl)-4-phenylmethoxyoxan-2-yl]oxydodecanoate Traditional Name: 12-(4-benzoxy-3,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)oxylauric acid methyl ester Formula: C26H42O8 MolecularWeight: 482.60688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCCOC1C(C(C(C(O1)CO)O)OCC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)CCCCCCCCCCCOC1C(C(C(C(O1)CO)O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C26H42O8/c1-31-22(28)16-12-7-5-3-2-4-6-8-13-17-32-26-24(30)25(23(29)21(18-27)34-26)33-19-20-14-10-9-11-15-20/h9-11,14-15,21,23-27,29-30H,2-8,12-13,16-19H2,1H3