TMM

1,3,5-BENZENETRICARBOXYLIC ACID

Created:	1999-07-08
Last modified:	2024-09-27

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3 entries where TMM is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	21
Chiral Atom Count	0
Bond Count	21
Aromatic Bond Count	6

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Chemical Component Summary
Name	1,3,5-BENZENETRICARBOXYLIC ACID
Systematic Name (OpenEye OEToolkits)	benzene-1,3,5-tricarboxylic acid
Formula	C₉ H₆ O₆
Molecular Weight	210.14
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)c1cc(cc(C(=O)O)c1)C(=O)O
SMILES	CACTVS	3.341	OC(=O)c1cc(cc(c1)C(O)=O)C(O)=O
SMILES	OpenEye OEToolkits	1.5.0	c1c(cc(cc1C(=O)O)C(=O)O)C(=O)O
Canonical SMILES	CACTVS	3.341	OC(=O)c1cc(cc(c1)C(O)=O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1c(cc(cc1C(=O)O)C(=O)O)C(=O)O
InChI	InChI	1.03	InChI=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)
InChIKey	InChI	1.03	QMKYBPDZANOJGF-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08632
Name	Trimesic acid
Groups	experimental
Synonyms	Trimesitinic acid Trimesic acid 5-carboxyisophthalic acid 1,3,5-Tricarboxybenzene Benzene-1,3,5-tricarboxylic acid Trimesinic acid
Categories	Acids, Acyclic
CAS number	554-95-0

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Hemoglobin subunit alpha	MVLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLS...	unknown
Hemoglobin subunit beta	MVHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLS...	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 Name	Reference
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