(1E,6E)-1,7-bis(5-methoxy-4-oxidanyl-2-propyl-phenyl)hepta-1,6-diene-3,5-dione

Systemtic Name: (1E,6E)-1,7-bis(5-methoxy-4-oxidanyl-2-propyl-phenyl)hepta-1,6-diene-3,5-dione Openeye Name: (1E,6E)-1,7-bis(4-hydroxy-5-methoxy-2-propyl-phenyl)hepta-1,6-diene-3,5-dione CAS Name: (1E,6E)-1,7-bis(4-hydroxy-5-methoxy-2-propylphenyl)hepta-1,6-diene-3,5-dione IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-5-methoxy-2-propylphenyl)hepta-1,6-diene-3,5-dione Traditional Name: (1E,6E)-1,7-bis(4-hydroxy-5-methoxy-2-propyl-phenyl)hepta-1,6-diene-3,5-dione Formula: C27H32O6 MolecularWeight: 452.53938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C=CC(=O)CC(=O)C=CC2=CC(=C(C=C2CCC)O)OC)OC)O

Isomeric SMILES

CCCC1=CC(=C(C=C1/C=C/C(=O)CC(=O)/C=C/C2=CC(=C(C=C2CCC)O)OC)OC)O

InChI

InChI=1S/C27H32O6/c1-5-7-18-13-24(30)26(32-3)15-20(18)9-11-22(28)17-23(29)12-10-21-16-27(33-4)25(31)14-19(21)8-6-2/h9-16,30-31H,5-8,17H2,1-4H3/b11-9+,12-10+