[(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] propanoate

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] propanoate 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] propanoate CAS Name: propanoic 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] 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] propanoate Traditional Name: propionic 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] ester Formula: C24H24O9 MolecularWeight: 456.44196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C2CC3COC(=O)C3C(C2=CC4=C1OCO4)C5=CC(=C(C(=C5)OC)O)OC

Isomeric SMILES

CCC(=O)OC1=C2C[C@H]3COC(=O)[C@@H]3[C@@H](C2=CC4=C1OCO4)C5=CC(=C(C(=C5)OC)O)OC

InChI

InChI=1S/C24H24O9/c1-4-18(25)33-22-14-5-12-9-30-24(27)20(12)19(13(14)8-17-23(22)32-10-31-17)11-6-15(28-2)21(26)16(7-11)29-3/h6-8,12,19-20,26H,4-5,9-10H2,1-3H3/t12-,19+,20-/m0/s1