2-(4-methoxy-3-oxidanyl-phenyl)-3,4,5-tris(oxidanyl)-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 2-(4-methoxy-3-oxidanyl-phenyl)-3,4,5-tris(oxidanyl)-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 3,4,5-trihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 3,4,5-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 3,4,5-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 3,4,5-trihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C16H16O7 MolecularWeight: 320.29404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=C3C(CC(=O)CC3O2)O)O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=C3C(CC(=O)CC3O2)O)O)O)O

InChI

InChI=1S/C16H16O7/c1-22-11-3-2-7(4-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-4,10,12,18-21H,5-6H2,1H3