2-[2-(hydroxymethyl)-4-methyl-6-oxidanyl-cyclohexyl]oxy-5-(3-methylbut-2-enyl)-6-oxidanyl-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 2-[2-(hydroxymethyl)-4-methyl-6-oxidanyl-cyclohexyl]oxy-5-(3-methylbut-2-enyl)-6-oxidanyl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 6-hydroxy-2-[2-hydroxy-6-(hydroxymethyl)-4-methyl-cyclohexoxy]-5-(3-methylbut-2-enyl)cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 6-hydroxy-2-[2-hydroxy-6-(hydroxymethyl)-4-methylcyclohexyl]oxy-5-(3-methylbut-2-enyl)-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 6-hydroxy-2-[2-hydroxy-6-(hydroxymethyl)-4-methylcyclohexyl]oxy-5-(3-methylbut-2-enyl)cyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 6-hydroxy-2-(2-hydroxy-4-methyl-6-methylol-cyclohexoxy)-5-(3-methylbut-2-enyl)cyclohexa-1,5-diene-1-carboxylic acid Formula: C20H30O6 MolecularWeight: 366.4486

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C1)O)OC2=C(C(=C(CC2)CC=C(C)C)O)C(=O)O)CO

Isomeric SMILES

CC1CC(C(C(C1)O)OC2=C(C(=C(CC2)CC=C(C)C)O)C(=O)O)CO

InChI

InChI=1S/C20H30O6/c1-11(2)4-5-13-6-7-16(17(18(13)23)20(24)25)26-19-14(10-21)8-12(3)9-15(19)22/h4,12,14-15,19,21-23H,5-10H2,1-3H3,(H,24,25)