2-[1-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3-(6-oxidanyl-1,3-benzodioxol-5-yl)-3-phenyl-propyl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3-(6-oxidanyl-1,3-benzodioxol-5-yl)-3-phenyl-propyl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-[3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-3-phenyl-propyl]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-[3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-3-phenylpropyl]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-[3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-3-phenylpropyl]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-[3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-3-phenyl-propyl]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C32H36O7 MolecularWeight: 532.62404

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(CC(C2=CC=CC=C2)C3=CC4=C(C=C3O)OCO4)C5=C(CC(CC5=O)(C)C)O)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(CC(C2=CC=CC=C2)C3=CC4=C(C=C3O)OCO4)C5=C(CC(CC5=O)(C)C)O)O)C

InChI

InChI=1S/C32H36O7/c1-31(2)13-23(34)29(24(35)14-31)21(30-25(36)15-32(3,4)16-26(30)37)10-19(18-8-6-5-7-9-18)20-11-27-28(12-22(20)33)39-17-38-27/h5-9,11-12,19,21,33-34,36H,10,13-17H2,1-4H3