5-[(2E)-3,7-dimethylocta-2,6-dienyl]-1-(3-methylbut-2-enyl)-3,4,6,8-tetrakis(oxidanyl)xanthen-9-one

Systemtic Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-1-(3-methylbut-2-enyl)-3,4,6,8-tetrakis(oxidanyl)xanthen-9-one Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5,6-tetrahydroxy-8-(3-methylbut-2-enyl)xanthen-9-one CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5,6-tetrahydroxy-8-(3-methylbut-2-enyl)-9-xanthenone IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5,6-tetrahydroxy-8-(3-methylbut-2-enyl)xanthen-9-one Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5,6-tetrahydroxy-8-(3-methylbut-2-enyl)xanthone Formula: C28H32O6 MolecularWeight: 464.55008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC1=C(C=C(C2=C1OC3=C(C2=O)C(=CC(=C3O)O)CC=C(C)C)O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC1=C(C=C(C2=C1OC3=C(C2=O)C(=CC(=C3O)O)CC=C(C)C)O)O)/C)C

InChI

InChI=1S/C28H32O6/c1-15(2)7-6-8-17(5)10-12-19-20(29)14-21(30)24-26(33)23-18(11-9-16(3)4)13-22(31)25(32)28(23)34-27(19)24/h7,9-10,13-14,29-32H,6,8,11-12H2,1-5H3/b17-10+