(E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)-7-oxidanyl-hept-1-ene-3,5-dione

Systemtic Name: (E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)-7-oxidanyl-hept-1-ene-3,5-dione Openeye Name: (E)-7-hydroxy-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-1-ene-3,5-dione CAS Name: (E)-7-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)-1-heptene-3,5-dione IUPAC Name: (E)-7-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3,5-dione Traditional Name: (E)-7-hydroxy-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-1-ene-3,5-dione Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)CC(=O)CC(C2=CC(=C(C=C2)O)OC)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)CC(C2=CC(=C(C=C2)O)OC)O)O

InChI

InChI=1S/C21H22O7/c1-27-20-9-13(4-7-17(20)24)3-6-15(22)11-16(23)12-19(26)14-5-8-18(25)21(10-14)28-2/h3-10,19,24-26H,11-12H2,1-2H3/b6-3+