[(5aR,8aR,9R)-9-(3,5-dimethoxy-4-oxidanyl-phenyl)-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-4-yl] (phenylmethyl) carbonate

Systemtic Name: [(5aR,8aR,9R)-9-(3,5-dimethoxy-4-oxidanyl-phenyl)-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-4-yl] (phenylmethyl) carbonate Openeye Name: [(5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxy-phenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-4-yl] benzyl carbonate CAS Name: carbonic acid [(5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-4-yl] (phenylmethyl) ester IUPAC Name: [(5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-4-yl] benzyl carbonate Traditional Name: carbonic acid [(5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxy-phenyl)-8-keto-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-4-yl] benzyl ester Formula: C29H26O10 MolecularWeight: 534.51074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)OC(=O)OCC6=CC=CC=C6)COC3=O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@@H](CC4=C(C5=C(C=C24)OCO5)OC(=O)OCC6=CC=CC=C6)COC3=O

InChI

InChI=1S/C29H26O10/c1-33-20-9-16(10-21(34-2)25(20)30)23-18-11-22-27(38-14-37-22)26(19(18)8-17-13-35-28(31)24(17)23)39-29(32)36-12-15-6-4-3-5-7-15/h3-7,9-11,17,23-24,30H,8,12-14H2,1-2H3/t17-,23+,24-/m0/s1