[6,7-dimethoxy-2-(4-methoxy-3-oxidanyl-phenyl)-5-oxidanyl-4-oxidanylidene-chromen-3-yl] hydrogen sulfate

Systemtic Name: [6,7-dimethoxy-2-(4-methoxy-3-oxidanyl-phenyl)-5-oxidanyl-4-oxidanylidene-chromen-3-yl] hydrogen sulfate Openeye Name: [5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-6,7-dimethoxy-4-oxo-chromen-3-yl] hydrogen sulfate CAS Name: sulfuric acid [5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-4-oxochromen-3-yl] hydrogen sulfate Traditional Name: sulfuric acid [5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-4-keto-6,7-dimethoxy-chromen-3-yl] ester Formula: C18H16O11S MolecularWeight: 440.37804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OS(=O)(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OS(=O)(=O)O)O

InChI

InChI=1S/C18H16O11S/c1-25-10-5-4-8(6-9(10)19)16-18(29-30(22,23)24)15(21)13-11(28-16)7-12(26-2)17(27-3)14(13)20/h4-7,19-20H,1-3H3,(H,22,23,24)