TMM

1,3,5-BENZENETRICARBOXYLIC ACID


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Chemical Component Summary

Name1,3,5-BENZENETRICARBOXYLIC ACID
Identifiersbenzene-1,3,5-tricarboxylic acid
FormulaC9 H6 O6
Molecular Weight210.14
TypeNON-POLYMER
Isomeric SMILESc1c(cc(cc1C(=O)O)C(=O)O)C(=O)O
InChIInChI=1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)
InChIKeyQMKYBPDZANOJGF-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count21
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB08632 
NameTrimesic acid
Groups experimental
Synonyms
  • Trimesitinic acid
  • 5-carboxyisophthalic acid
  • Benzene-1,3,5-tricarboxylic acid
  • Trimesinic acid
  • 1,3,5-Tricarboxybenzene
CategoriesAcids, Acyclic
CAS number554-95-0

Drug Targets

NameTarget SequencePharmacological ActionActions
Hemoglobin subunit alphaMVLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLS...unknown
Hemoglobin subunit betaMVHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLS...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 11138
ChEMBL CHEMBL77562
ChEBI CHEBI:46032
CCDC/CSD GIRDAN, COXPAH, FECJEF, AVELAO, ABUNAM01, AWAXOM07, CAFVOW, HUHQUZ, AWAXOM02, ABUNAM, AWAXOM08, GLYTMS, INACUW, AWAXOM03, AWAXOM09, FEXLAY, AWAXOM04, IKAJIN, AWAXOM10, INACOQ, EXAGIT, AWAXOM05, AWAXOM11, GIRDER, CAFVUC, AWAXAY, GIRDIV, AFABEP, GAZGEW, AWAXOM06, AWAXOM01, EWUTEV, ILELAO, EVANAR, AVILUN, AWAXIG, AWAXOM, FONHEW, HUHQIN01, AWITOS, GIRDER01, IPAXEF, BTCOAC05
COD 2019426, 7051122, 2218685, 7102655, 2218748, 2239261, 1555269, 2202199, 1505109, 2233323, 2230888, 2241178, 2206049