6-(hydroxymethyl)-2-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]-2-phenylmethoxy-oxane-3,4,5-triol

Systemtic Name: 6-(hydroxymethyl)-2-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]-2-phenylmethoxy-oxane-3,4,5-triol Openeye Name: 2-benzyloxy-6-(hydroxymethyl)-2-[7-(p-tolylmethyl)benzothiophen-2-yl]tetrahydropyran-3,4,5-triol CAS Name: 6-(hydroxymethyl)-2-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]-2-phenylmethoxyoxane-3,4,5-triol IUPAC Name: 6-(hydroxymethyl)-2-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]-2-phenylmethoxyoxane-3,4,5-triol Traditional Name: 2-benzoxy-2-[7-(4-methylbenzyl)benzothiophen-2-yl]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C29H30O6S MolecularWeight: 506.6099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CC=CC3=C2SC(=C3)C4(C(C(C(C(O4)CO)O)O)O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CC=CC3=C2SC(=C3)C4(C(C(C(C(O4)CO)O)O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H30O6S/c1-18-10-12-19(13-11-18)14-21-8-5-9-22-15-24(36-27(21)22)29(34-17-20-6-3-2-4-7-20)28(33)26(32)25(31)23(16-30)35-29/h2-13,15,23,25-26,28,30-33H,14,16-17H2,1H3