5-methoxy-7-methyl-2-(2-methyl-3-oxidanylidene-butan-2-yl)-2,4,6,8,9-pentakis(oxidanyl)phenalene-1,3-dione

Systemtic Name: 5-methoxy-7-methyl-2-(2-methyl-3-oxidanylidene-butan-2-yl)-2,4,6,8,9-pentakis(oxidanyl)phenalene-1,3-dione Openeye Name: 2-(1,1-dimethyl-2-oxo-propyl)-2,4,5,7,9-pentahydroxy-8-methoxy-6-methyl-phenalene-1,3-dione CAS Name: 2,4,5,7,9-pentahydroxy-8-methoxy-6-methyl-2-(2-methyl-3-oxobutan-2-yl)phenalene-1,3-dione IUPAC Name: 2,4,5,7,9-pentahydroxy-8-methoxy-6-methyl-2-(2-methyl-3-oxobutan-2-yl)phenalene-1,3-dione Traditional Name: 2,4,5,7,9-pentahydroxy-2-(2-keto-1,1-dimethyl-propyl)-8-methoxy-6-methyl-phenalene-1,3-quinone Formula: C20H20O9 MolecularWeight: 404.3674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C3=C1C(=C(C(=C3C(=O)C(C2=O)(C(C)(C)C(=O)C)O)O)OC)O)O)O

Isomeric SMILES

CC1=C(C(=C2C3=C1C(=C(C(=C3C(=O)C(C2=O)(C(C)(C)C(=O)C)O)O)OC)O)O)O

InChI

InChI=1S/C20H20O9/c1-6-8-9-10(13(23)12(6)22)17(26)20(28,19(3,4)7(2)21)18(27)11(9)15(25)16(29-5)14(8)24/h22-25,28H,1-5H3