3-[[3-carboxy-5-(4-hydroxyphenyl)-2-oxidanyl-phenyl]methyl]-5-(4-hydroxyphenyl)-2-oxidanyl-benzoic acid

Systemtic Name: 3-[[3-carboxy-5-(4-hydroxyphenyl)-2-oxidanyl-phenyl]methyl]-5-(4-hydroxyphenyl)-2-oxidanyl-benzoic acid Openeye Name: 3-[[3-carboxy-2-hydroxy-5-(4-hydroxyphenyl)phenyl]methyl]-2-hydroxy-5-(4-hydroxyphenyl)benzoic acid CAS Name: 3-[[3-carboxy-2-hydroxy-5-(4-hydroxyphenyl)phenyl]methyl]-2-hydroxy-5-(4-hydroxyphenyl)benzoic acid IUPAC Name: 3-[[3-carboxy-2-hydroxy-5-(4-hydroxyphenyl)phenyl]methyl]-2-hydroxy-5-(4-hydroxyphenyl)benzoic acid Traditional Name: 3-[3-carboxy-2-hydroxy-5-(4-hydroxyphenyl)benzyl]-2-hydroxy-5-(4-hydroxyphenyl)benzoic acid Formula: C27H20O8 MolecularWeight: 472.4429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C(=C2)CC3=CC(=CC(=C3O)C(=O)O)C4=CC=C(C=C4)O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C(=C2)CC3=CC(=CC(=C3O)C(=O)O)C4=CC=C(C=C4)O)O)C(=O)O)O

InChI

InChI=1S/C27H20O8/c28-20-5-1-14(2-6-20)16-9-18(24(30)22(12-16)26(32)33)11-19-10-17(13-23(25(19)31)27(34)35)15-3-7-21(29)8-4-15/h1-10,12-13,28-31H,11H2,(H,32,33)(H,34,35)