methyl (1R,2R,3S,3aR,8bS)-8-[[6-[1,2-bis(oxidanyl)ethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-6-methoxy-3a-(4-methoxyphenyl)-1,8b-bis(oxidanyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate

Systemtic Name: methyl (1R,2R,3S,3aR,8bS)-8-[[6-[1,2-bis(oxidanyl)ethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-6-methoxy-3a-(4-methoxyphenyl)-1,8b-bis(oxidanyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate Openeye Name: methyl (1R,2R,3S,3aR,8bS)-8-[[6-(1,2-dihydroxyethyl)-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylate CAS Name: (1R,2R,3S,3aR,8bS)-8-[[6-(1,2-dihydroxyethyl)-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3S,3aR,8bS)-8-[[6-(1,2-dihydroxyethyl)-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate Traditional Name: (1R,2R,3S,3aR,8bS)-8-[[6-(1,2-dihydroxyethyl)-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylic acid methyl ester Formula: C34H38O13 MolecularWeight: 654.65772

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(OC(CO1)C(CO)O)OC2=C3C(=CC(=C2)OC)OC4(C3(C(C(C4C5=CC=CC=C5)C(=O)OC)O)O)C6=CC=C(C=C6)OC

Isomeric SMILES

COC1C(OC(CO1)C(CO)O)OC2=C3C(=CC(=C2)OC)O[C@@]4([C@]3([C@@H]([C@@H]([C@H]4C5=CC=CC=C5)C(=O)OC)O)O)C6=CC=C(C=C6)OC

InChI

InChI=1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(14-21(41-2)15-24(28)47-34)45-32-31(43-4)44-17-25(46-32)22(36)16-35/h5-15,22,25-27,29,31-32,35-37,39H,16-17H2,1-4H3/t22?,25?,26-,27-,29-,31?,32?,33+,34+/m1/s1