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FGT

Summary
Name:3,3-bis(4-hydroxyphenyl)-2-benzofuran-1-one
Synonyms:phenolphthalein
Formula:C20 H14 O4
Formal charge:0
Formula weight:318.323 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63,3-bis(4-hydroxyphenyl)-2-benzofuran-1-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22H
InChIKeyInChI1.03KJFMBFZCATUALV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc(cc1)C2(OC(=O)c3ccccc23)c4ccc(O)cc4
SMILESCACTVS3.385Oc1ccc(cc1)C2(OC(=O)c3ccccc23)c4ccc(O)cc4
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc2c(c1)C(=O)OC2(c3ccc(cc3)O)c4ccc(cc4)O
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)C(=O)OC2(c3ccc(cc3)O)c4ccc(cc4)O

218853

PDB entries from 2024-04-24

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