4,4,5-tris(3-methylbut-2-enyl)-1,6,8-tris(oxidanyl)xanthene-3,9-dione

Systemtic Name: 4,4,5-tris(3-methylbut-2-enyl)-1,6,8-tris(oxidanyl)xanthene-3,9-dione Openeye Name: 1,6,8-trihydroxy-4,4,5-tris(3-methylbut-2-enyl)xanthene-3,9-dione CAS Name: 1,6,8-trihydroxy-4,4,5-tris(3-methylbut-2-enyl)xanthene-3,9-dione IUPAC Name: 1,6,8-trihydroxy-4,4,5-tris(3-methylbut-2-enyl)xanthene-3,9-dione Traditional Name: 1,6,8-trihydroxy-4,4,5-tris(3-methylbut-2-enyl)xanthene-3,9-quinone Formula: C28H32O6 MolecularWeight: 464.55008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C2=C1OC3=C(C2=O)C(=CC(=O)C3(CC=C(C)C)CC=C(C)C)O)O)O)C

Isomeric SMILES

CC(=CCC1=C(C=C(C2=C1OC3=C(C2=O)C(=CC(=O)C3(CC=C(C)C)CC=C(C)C)O)O)O)C

InChI

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