6-(hydroxymethyl)-3-oxidanyl-2-[oxidanyl(phenyl)methyl]pyran-4-one

Systemtic Name: 6-(hydroxymethyl)-3-oxidanyl-2-[oxidanyl(phenyl)methyl]pyran-4-one Openeye Name: 3-hydroxy-6-(hydroxymethyl)-2-[hydroxy(phenyl)methyl]pyran-4-one CAS Name: 3-hydroxy-6-(hydroxymethyl)-2-[hydroxy(phenyl)methyl]-4-pyranone IUPAC Name: 3-hydroxy-6-(hydroxymethyl)-2-[hydroxy(phenyl)methyl]pyran-4-one Traditional Name: 3-hydroxy-2-[hydroxy(phenyl)methyl]-6-methylol-pyran-4-one Formula: C13H12O5 MolecularWeight: 248.23138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C(=O)C=C(O2)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C(=O)C=C(O2)CO)O)O

InChI

InChI=1S/C13H12O5/c14-7-9-6-10(15)12(17)13(18-9)11(16)8-4-2-1-3-5-8/h1-6,11,14,16-17H,7H2