Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0I1EP
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| Former ID |
DIB020449
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| Drug Name |
MRS928
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| Synonyms |
3,5,7-Trimethoxyflavone; 3,5,7-Trimethoxy-2-phenyl-4H-chromen-4-one; Galangin trimethyl ether; 26964-29-4; Galangin 3,5,7-trimethyl ether; 3,5,7-Trimethoxy-2-phenylchromen-4-one; Chromen-4-one, 3,5,7-trimethoxy-2-phenyl-; CHEMBL75772; CHEBI:5263; CBTHKWVPSIGKMI-UHFFFAOYSA-N; Flavone, 3,5,7-trimethoxy-; 3,5,7-Trimethoxy-2-phenyl-chromen-4-one; AC1L3LSQ; C10045; AC1Q6E1K; GTPL402; 3,5,7-Tri-O-methylgalangin; MEGxp0_001894; 4H-1-Benzopyran-4-one, 3,5,7-trimethoxy-2-phenyl-; SCHEMBL1664287; CTK8D5933; ACon1_000793; galangin trimethyl ether
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2] | |
| Structure |
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Download2D MOL |
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| Formula |
C18H16O5
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| Canonical SMILES |
COC1=CC2=C(C(=C1)OC)C(=O)C(=C(O2)C3=CC=CC=C3)OC
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| InChI |
1S/C18H16O5/c1-20-12-9-13(21-2)15-14(10-12)23-17(18(22-3)16(15)19)11-7-5-4-6-8-11/h4-10H,1-3H3
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| InChIKey |
CBTHKWVPSIGKMI-UHFFFAOYSA-N
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| CAS Number |
CAS 26964-29-4
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| PubChem Compound ID | ||||
| PubChem Substance ID |
12231, 4789230, 10237774, 14999475, 29299004, 47359796, 47434753, 50113887, 75019354, 85295315, 85842715, 103126283, 103273649, 103979738, 104404423, 117590617, 126433994, 127601894, 134341603, 135075804, 135650667, 163110847, 175611515, 179230599, 223439785, 225068565, 227851943, 241047187, 250118206
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| ChEBI ID |
CHEBI:5263
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 402). | |||
| REF 2 | Interactions of flavonoids and other phytochemicals with adenosine receptors. J Med Chem. 1996 Feb 2;39(3):781-8. | |||
| REF 3 | Synthesis and biological activities of flavonoid derivatives as A3 adenosine receptor antagonists. J Med Chem. 1996 Jun 7;39(12):2293-301. | |||
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