2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4,5,6-tetrol; 3-phenylchromen-4-one

Systemtic Name: 2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4,5,6-tetrol; 3-phenylchromen-4-one Openeye Name: 2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4,5,6-tetrol; 3-phenylchromen-4-one CAS Name: 2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4,5,6-tetrol; 3-phenyl-1-benzopyran-4-one IUPAC Name: 2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4,5,6-tetrol; 3-phenylchromen-4-one Traditional Name: isoflavone; 2-methylol-3,4-dihydro-2H-pyran-3,4,5,6-tetrol Formula: C21H20O8 MolecularWeight: 400.3787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=COC3=CC=CC=C3C2=O.C(C1C(C(C(=C(O1)O)O)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=COC3=CC=CC=C3C2=O.C(C1C(C(C(=C(O1)O)O)O)O)O

InChI

InChI=1S/C15H10O2.C6H10O6/c16-15-12-8-4-5-9-14(12)17-10-13(15)11-6-2-1-3-7-11;7-1-2-3(8)4(9)5(10)6(11)12-2/h1-10H;2-4,7-11H,1H2