DBF

DIBENZOFURAN-4,6-DICARBOXYLIC ACID

Created: 2000-01-28
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count29
Aromatic Bond Count15
2D diagram of DBF
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Chemical Component Summary

NameDIBENZOFURAN-4,6-DICARBOXYLIC ACID
Systematic Name (OpenEye OEToolkits)dibenzofuran-4,6-dicarboxylic acid
FormulaC14 H8 O5
Molecular Weight256.21
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)c3c2oc1c(cccc1c2ccc3)C(=O)O
SMILESCACTVS3.341OC(=O)c1cccc2c1oc3c(cccc23)C(O)=O
SMILESOpenEye OEToolkits1.5.0c1cc2c3cccc(c3oc2c(c1)C(=O)O)C(=O)O
Canonical SMILESCACTVS3.341 OC(=O)c1cccc2c1oc3c(cccc23)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc2c3cccc(c3oc2c(c1)C(=O)O)C(=O)O
InChIInChI1.03 InChI=1S/C14H8O5/c15-13(16)9-5-1-3-7-8-4-2-6-10(14(17)18)12(8)19-11(7)9/h1-6H,(H,15,16)(H,17,18)
InChIKeyInChI1.03 HBBGSNOHAGNQRQ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB03682 
NameDibenzofuran-4,6-Dicarboxylic Acid
Groups experimental
SynonymsDibenzofuran-4,6-Dicarboxylic Acid
Categories
  • Acids, Acyclic
  • Heterocyclic Compounds, Fused-Ring

Drug Targets

NameTarget SequencePharmacological ActionActions
TransthyretinMASHRLLLLCLAGLVFVSEAGPTGTGESKCPLMVKVLDAVRGSPAINVAV...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 3022