4-[(4E)-5,9-dimethyl-2-prop-1-en-2-yl-deca-4,8-dienyl]-3-methyl-1,5,6-tris(oxidanyl)xanthen-9-one

Systemtic Name: 4-[(4E)-5,9-dimethyl-2-prop-1-en-2-yl-deca-4,8-dienyl]-3-methyl-1,5,6-tris(oxidanyl)xanthen-9-one Openeye Name: 1,5,6-trihydroxy-4-[(4E)-2-isopropenyl-5,9-dimethyl-deca-4,8-dienyl]-3-methyl-xanthen-9-one CAS Name: 4-[(4E)-5,9-dimethyl-2-(1-methylethenyl)deca-4,8-dienyl]-1,5,6-trihydroxy-3-methyl-9-xanthenone IUPAC Name: 4-[(4E)-5,9-dimethyl-2-prop-1-en-2-yldeca-4,8-dienyl]-1,5,6-trihydroxy-3-methylxanthen-9-one Traditional Name: 1,5,6-trihydroxy-4-[(4E)-2-isopropenyl-5,9-dimethyl-deca-4,8-dienyl]-3-methyl-xanthone Formula: C29H34O5 MolecularWeight: 462.57726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1CC(CC=C(C)CCC=C(C)C)C(=C)C)OC3=C(C2=O)C=CC(=C3O)O)O

Isomeric SMILES

CC1=CC(=C2C(=C1CC(C/C=C(\C)/CCC=C(C)C)C(=C)C)OC3=C(C2=O)C=CC(=C3O)O)O

InChI

InChI=1S/C29H34O5/c1-16(2)8-7-9-18(5)10-11-20(17(3)4)15-22-19(6)14-24(31)25-26(32)21-12-13-23(30)27(33)29(21)34-28(22)25/h8,10,12-14,20,30-31,33H,3,7,9,11,15H2,1-2,4-6H3/b18-10+