3-[2-[3,4-bis(oxidanyl)phenyl]-3-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)propyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[2-[3,4-bis(oxidanyl)phenyl]-3-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)propyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[2-(3,4-dihydroxyphenyl)-3-(2-hydroxy-6-methyl-4-oxo-pyran-3-yl)propyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[2-(3,4-dihydroxyphenyl)-3-(2-hydroxy-6-methyl-4-oxo-3-pyranyl)propyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[2-(3,4-dihydroxyphenyl)-3-(2-hydroxy-6-methyl-4-oxopyran-3-yl)propyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[2-(3,4-dihydroxyphenyl)-3-(2-hydroxy-4-keto-6-methyl-pyran-3-yl)propyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C21H20O8 MolecularWeight: 400.3787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)CC(CC2=C(OC(=CC2=O)C)O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)CC(CC2=C(OC(=CC2=O)C)O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C21H20O8/c1-10-5-17(23)14(20(26)28-10)7-13(12-3-4-16(22)19(25)9-12)8-15-18(24)6-11(2)29-21(15)27/h3-6,9,13,22,25-27H,7-8H2,1-2H3