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VII

Summary
Name:2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID
Synonyms:2-5-DIPHENYL-3,4-FURANDICARBOXYLIC ACID
Formula:C18 H12 O5
Formal charge:0
Formula weight:308.285 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042,5-diphenylfuran-3,4-dicarboxylic acid
OpenEye OEToolkits1.5.02,5-diphenylfuran-3,4-dicarboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)c2c(oc(c1ccccc1)c2C(=O)O)c3ccccc3
SMILES_CANONICALCACTVS3.341OC(=O)c1c(oc(c2ccccc2)c1C(O)=O)c3ccccc3
SMILESCACTVS3.341OC(=O)c1c(oc(c2ccccc2)c1C(O)=O)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc(cc1)c2c(c(c(o2)c3ccccc3)C(=O)O)C(=O)O
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)c2c(c(c(o2)c3ccccc3)C(=O)O)C(=O)O
InChIInChI1.03InChI=1S/C18H12O5/c19-17(20)13-14(18(21)22)16(12-9-5-2-6-10-12)23-15(13)11-7-3-1-4-8-11/h1-10H,(H,19,20)(H,21,22)
InChIKeyInChI1.03QPKYPOMZPFDBEZ-UHFFFAOYSA-N

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PDB entries from 2024-07-10

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