4-(2-methylbutanoyl)-2,6-bis(3-methylbut-2-enyl)-5,6-bis(oxidanyl)cyclohex-4-ene-1,3-dione

Systemtic Name: 4-(2-methylbutanoyl)-2,6-bis(3-methylbut-2-enyl)-5,6-bis(oxidanyl)cyclohex-4-ene-1,3-dione Openeye Name: 5,6-dihydroxy-4-(2-methylbutanoyl)-2,6-bis(3-methylbut-2-enyl)cyclohex-4-ene-1,3-dione CAS Name: 5,6-dihydroxy-2,6-bis(3-methylbut-2-enyl)-4-(2-methyl-1-oxobutyl)cyclohex-4-ene-1,3-dione IUPAC Name: 5,6-dihydroxy-4-(2-methylbutanoyl)-2,6-bis(3-methylbut-2-enyl)cyclohex-4-ene-1,3-dione Traditional Name: 5,6-dihydroxy-4-(2-methylbutanoyl)-2,6-bis(3-methylbut-2-enyl)cyclohex-4-ene-1,3-quinone Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C1=C(C(C(=O)C(C1=O)CC=C(C)C)(CC=C(C)C)O)O

Isomeric SMILES

CCC(C)C(=O)C1=C(C(C(=O)C(C1=O)CC=C(C)C)(CC=C(C)C)O)O

InChI

InChI=1S/C21H30O5/c1-7-14(6)17(22)16-18(23)15(9-8-12(2)3)19(24)21(26,20(16)25)11-10-13(4)5/h8,10,14-15,25-26H,7,9,11H2,1-6H3