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

Systemtic Name: 2-[(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-[3-(hydroxymethyl)-4-methoxy-phenyl]methyl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-[3-(hydroxymethyl)-4-methoxy-phenyl]methyl]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-[(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-(4-methoxy-3-methylol-phenyl)methyl]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C25H32O6 MolecularWeight: 428.51798

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(C2=CC(=C(C=C2)OC)CO)C3=C(CC(CC3=O)(C)C)O)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(C2=CC(=C(C=C2)OC)CO)C3=C(CC(CC3=O)(C)C)O)O)C

InChI

InChI=1S/C25H32O6/c1-24(2)9-16(27)22(17(28)10-24)21(14-6-7-20(31-5)15(8-14)13-26)23-18(29)11-25(3,4)12-19(23)30/h6-8,21,26-27,29H,9-13H2,1-5H3