1,1,7-tris(3-methylbut-2-enyl)-6,8,9-tris(oxidanyl)xanthene-2,3-dione

Systemtic Name: 1,1,7-tris(3-methylbut-2-enyl)-6,8,9-tris(oxidanyl)xanthene-2,3-dione Openeye Name: 6,8,9-trihydroxy-1,1,7-tris(3-methylbut-2-enyl)xanthene-2,3-dione CAS Name: 6,8,9-trihydroxy-1,1,7-tris(3-methylbut-2-enyl)xanthene-2,3-dione IUPAC Name: 6,8,9-trihydroxy-1,1,7-tris(3-methylbut-2-enyl)xanthene-2,3-dione Traditional Name: 6,8,9-trihydroxy-1,1,7-tris(3-methylbut-2-enyl)xanthene-2,3-quinone Formula: C28H32O6 MolecularWeight: 464.55008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C2C(=C1O)C(=C3C(=CC(=O)C(=O)C3(CC=C(C)C)CC=C(C)C)O2)O)O)C

Isomeric SMILES

CC(=CCC1=C(C=C2C(=C1O)C(=C3C(=CC(=O)C(=O)C3(CC=C(C)C)CC=C(C)C)O2)O)O)C

InChI

InChI=1S/C28H32O6/c1-15(2)7-8-18-19(29)13-21-23(25(18)31)26(32)24-22(34-21)14-20(30)27(33)28(24,11-9-16(3)4)12-10-17(5)6/h7,9-10,13-14,29,31-32H,8,11-12H2,1-6H3