Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0F2WQ
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| Former ID |
DNC003337
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| Drug Name |
1,3,5-BENZENETRICARBOXYLIC ACID
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| Synonyms |
Trimesic acid; 554-95-0; 1,3,5-BENZENETRICARBOXYLIC ACID; benzene-1,3,5-tricarboxylic acid; Trimesinic acid; Trimesitinic acid; 5-Carboxyisophthalic acid; 1,3,5-Benzene tricarboxylic acid; 1,3,5-Tricarboxybenzene; UNII-OU36OO5MTN; NSC 3998; EINECS 209-077-7; OU36OO5MTN; CHEMBL77562; AI3-06468; CHEBI:46032; QMKYBPDZANOJGF-UHFFFAOYSA-N; MFCD00002517; Trimesicacid; 1,3,5-Benzenetricarboxylic acid, 98%; 1.3.5-Benzenetricarboxylic Acid; H3BTCt; Trimesic acid, 95%; 1,5-Tricarboxybenzene; PubChem18615; H3TMA; AC1Q1GOL; DSSTox_CID_1488
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C9H6O6
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| Canonical SMILES |
C1=C(C=C(C=C1C(=O)O)C(=O)O)C(=O)O
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| 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)
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| InChIKey |
QMKYBPDZANOJGF-UHFFFAOYSA-N
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| CAS Number |
CAS 554-95-0
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| PubChem Compound ID | ||||
| PubChem Substance ID |
70398, 587875, 607588, 3132064, 5410128, 8158120, 10526984, 11456889, 15220195, 24871843, 24889614, 26697096, 29279469, 48414680, 49833510, 50077789, 51072470, 57326718, 79965308, 85090118, 85171730, 87556690, 87563254, 91057183, 99445103, 103281395, 103980446, 104325234, 117356292, 118080849, 124954711, 125353051, 126535936, 126589656, 126632608, 126658797, 126677833, 129044037, 129235616, 131466018, 134212794, 134976340, 135699347, 137007397, 142039880, 143434816, 143489408, 143857319, 144207215, 152195210
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| ChEBI ID |
CHEBI:46032
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| References | Top | |||
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| REF 1 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
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