(3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenzo[d][2]benzofuran-1,3-diol

Systemtic Name: (3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenzo[d][2]benzofuran-1,3-diol Openeye Name: (3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenzo[d]isobenzofuran-1,3-diol CAS Name: (3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenzo[d]isobenzofuran-1,3-diol IUPAC Name: (3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenzo[d][2]benzofuran-1,3-diol Traditional Name: (3aS,4S,6aS,9S,10R,10aR)-4-(dimethoxymethyl)-9,10-bis(methoxymethoxy)-7,7-dimethyl-1,3,3a,4,6a,8,9,10-octahydrobenz[d]isobenzofuran-1,3-diol Formula: C21H36O9 MolecularWeight: 432.50514

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(C23C1C=CC(C2C(OC3O)O)C(OC)OC)OCOC)OCOC)C

Isomeric SMILES

CC1(C[C@@H]([C@@H]([C@@]23[C@H]1C=C[C@@H]([C@@H]2C(OC3O)O)C(OC)OC)OCOC)OCOC)C

InChI

InChI=1S/C21H36O9/c1-20(2)9-13(28-10-24-3)16(29-11-25-4)21-14(20)8-7-12(18(26-5)27-6)15(21)17(22)30-19(21)23/h7-8,12-19,22-23H,9-11H2,1-6H3/t12-,13-,14-,15+,16-,17?,19?,21+/m0/s1