[(6S,7S,9R,9aS)-6,9a-dimethyl-6-(4-methylpent-3-enyl)-9-oxidanyl-1-oxidanylidene-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-7-yl] ethanoate

Systemtic Name: [(6S,7S,9R,9aS)-6,9a-dimethyl-6-(4-methylpent-3-enyl)-9-oxidanyl-1-oxidanylidene-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-7-yl] ethanoate Openeye Name: [(6S,7S,9R,9aS)-9-hydroxy-6,9a-dimethyl-6-(4-methylpent-3-enyl)-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e]isobenzofuran-7-yl] acetate CAS Name: acetic acid [(6S,7S,9R,9aS)-9-hydroxy-6,9a-dimethyl-6-(4-methylpent-3-enyl)-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e]isobenzofuran-7-yl] ester IUPAC Name: [(6S,7S,9R,9aS)-9-hydroxy-6,9a-dimethyl-6-(4-methylpent-3-enyl)-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-7-yl] acetate Traditional Name: acetic acid [(6S,7S,9R,9aS)-9-hydroxy-1-keto-6,9a-dimethyl-6-(4-methylpent-3-enyl)-4,5,5a,7,8,9-hexahydro-3H-benz[e]isobenzofuran-7-yl] ester Formula: C22H32O5 MolecularWeight: 376.48648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1(C2CCC3=C(C2(C(CC1OC(=O)C)O)C)C(=O)OC3)C)C

Isomeric SMILES

CC(=CCC[C@@]1([C@H](C[C@H]([C@]2(C1CCC3=C2C(=O)OC3)C)O)OC(=O)C)C)C

InChI

InChI=1S/C22H32O5/c1-13(2)7-6-10-21(4)16-9-8-15-12-26-20(25)19(15)22(16,5)17(24)11-18(21)27-14(3)23/h7,16-18,24H,6,8-12H2,1-5H3/t16?,17-,18+,21+,22-/m1/s1