VII

2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID

Created: 2006-03-30
Last modified:  2021-03-13

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Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count37
Aromatic Bond Count19
2D diagram of VII
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Chemical Component Summary

Name2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID
Synonyms2-5-DIPHENYL-3,4-FURANDICARBOXYLIC ACID
Systematic Name (OpenEye OEToolkits)2,5-diphenylfuran-3,4-dicarboxylic acid
FormulaC18 H12 O5
Molecular Weight308.285
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)c2c(oc(c1ccccc1)c2C(=O)O)c3ccccc3
SMILESCACTVS3.341OC(=O)c1c(oc(c2ccccc2)c1C(O)=O)c3ccccc3
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)c2c(c(c(o2)c3ccccc3)C(=O)O)C(=O)O
Canonical SMILESCACTVS3.341 OC(=O)c1c(oc(c2ccccc2)c1C(O)=O)c3ccccc3
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(cc1)c2c(c(c(o2)c3ccccc3)C(=O)O)C(=O)O
InChIInChI1.03 InChI=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)
InChIKeyInChI1.03 QPKYPOMZPFDBEZ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB08702 
Name2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID
Groups experimental
Synonyms2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID

Drug Targets

NameTarget SequencePharmacological ActionActions
Metallo-beta-lactamase L1MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADH...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 220535