[3,4,5-tris(oxidanyl)-6-[2,2,4,4-tetramethyl-6-(2-methylprop-1-enyl)-6-oxidanyl-3,5-bis(oxidanylidene)cyclohexyl]oxy-oxan-2-yl]methyl 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: [3,4,5-tris(oxidanyl)-6-[2,2,4,4-tetramethyl-6-(2-methylprop-1-enyl)-6-oxidanyl-3,5-bis(oxidanylidene)cyclohexyl]oxy-oxan-2-yl]methyl 3,4,5-tris(oxidanyl)benzoate Openeye Name: [3,4,5-trihydroxy-6-[2-hydroxy-4,4,6,6-tetramethyl-2-(2-methylprop-1-enyl)-3,5-dioxo-cyclohexoxy]tetrahydropyran-2-yl]methyl 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid [3,4,5-trihydroxy-6-[2-hydroxy-4,4,6,6-tetramethyl-2-(2-methylprop-1-enyl)-3,5-dioxocyclohexyl]oxy-2-oxanyl]methyl ester IUPAC Name: [3,4,5-trihydroxy-6-[2-hydroxy-4,4,6,6-tetramethyl-2-(2-methylprop-1-enyl)-3,5-dioxocyclohexyl]oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid [3,4,5-trihydroxy-6-[2-hydroxy-3,5-diketo-4,4,6,6-tetramethyl-2-(2-methylprop-1-enyl)cyclohexoxy]tetrahydropyran-2-yl]methyl ester Formula: C27H36O13 MolecularWeight: 568.56694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1(C(C(C(=O)C(C1=O)(C)C)(C)C)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O)C

Isomeric SMILES

CC(=CC1(C(C(C(=O)C(C1=O)(C)C)(C)C)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O)C

InChI

InChI=1S/C27H36O13/c1-11(2)9-27(37)23(36)25(3,4)22(35)26(5,6)24(27)40-21-19(33)18(32)17(31)15(39-21)10-38-20(34)12-7-13(28)16(30)14(29)8-12/h7-9,15,17-19,21,24,28-33,37H,10H2,1-6H3