(3R,4R)-3-[[(2S,3R)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-5-yl]methyl]-4-[[3-methoxy-5-[1-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-phenyl]methyl]oxolan-2-one

Systemtic Name: (3R,4R)-3-[[(2S,3R)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-5-yl]methyl]-4-[[3-methoxy-5-[1-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-phenyl]methyl]oxolan-2-one Openeye Name: (3R,4R)-4-[[4-hydroxy-3-[2-(4-hydroxy-3-methoxy-phenyl)-1-(hydroxymethyl)-2-oxo-ethyl]-5-methoxy-phenyl]methyl]-3-[[(2S,3R)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]methyl]tetrahydrofuran-2-one CAS Name: (3R,4R)-4-[[4-hydroxy-3-[3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-oxopropan-2-yl]-5-methoxyphenyl]methyl]-3-[[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]methyl]-2-oxolanone IUPAC Name: (3R,4R)-4-[[4-hydroxy-3-[3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-oxopropan-2-yl]-5-methoxyphenyl]methyl]-3-[[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl]oxolan-2-one Traditional Name: (3R,4R)-4-[4-hydroxy-3-[2-(4-hydroxy-3-methoxy-phenyl)-2-keto-1-methylol-ethyl]-5-methoxy-benzyl]-3-[[(2S,3R)-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-3-methylol-coumaran-5-yl]methyl]tetrahydrofuran-2-one Formula: C40H42O13 MolecularWeight: 730.75368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)C(CO)C(=O)C2=CC(=C(C=C2)O)OC)CC3COC(=O)C3CC4=CC(=C5C(=C4)C(C(O5)C6=CC(=C(C=C6)O)OC)CO)OC

Isomeric SMILES

COC1=CC(=CC(=C1O)C(CO)C(=O)C2=CC(=C(C=C2)O)OC)C[C@H]3COC(=O)[C@@H]3CC4=CC(=C5C(=C4)[C@@H]([C@H](O5)C6=CC(=C(C=C6)O)OC)CO)OC

InChI

InChI=1S/C40H42O13/c1-48-32-15-22(5-7-30(32)43)36(45)28(17-41)26-11-20(13-34(50-3)37(26)46)9-24-19-52-40(47)25(24)10-21-12-27-29(18-42)38(53-39(27)35(14-21)51-4)23-6-8-31(44)33(16-23)49-2/h5-8,11-16,24-25,28-29,38,41-44,46H,9-10,17-19H2,1-4H3/t24-,25+,28?,29-,38+/m0/s1