methyl 3,4,5-tris(oxidanyl)-6-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-oxane-2-carboxylate

Systemtic Name: methyl 3,4,5-tris(oxidanyl)-6-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-oxane-2-carboxylate Openeye Name: methyl 3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-tetrahydropyran-2-carboxylate CAS Name: 3,4,5-trihydroxy-6-[(5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-yl)oxy]-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl 3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylate Traditional Name: 3,4,5-trihydroxy-6-(5-hydroxy-4-keto-2-phenyl-chromen-7-yl)oxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C22H20O10 MolecularWeight: 444.3882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O)O)O)O

Isomeric SMILES

COC(=O)C1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O)O)O)O

InChI

InChI=1S/C22H20O10/c1-29-21(28)20-18(26)17(25)19(27)22(32-20)30-11-7-12(23)16-13(24)9-14(31-15(16)8-11)10-5-3-2-4-6-10/h2-9,17-20,22-23,25-27H,1H3