Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0M9RL
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| Former ID |
DNC012498
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| Drug Name |
2-(3'-Allyl-biphenyl-4-yl)-propionic acid
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| Synonyms |
CHEMBL325787; BDBM50074936; 2-(3''-Allyl-biphenyl-4-yl)-propionic acid
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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 |
C18H18O2
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| Canonical SMILES |
CC(C1=CC=C(C=C1)C2=CC=CC(=C2)CC=C)C(=O)O
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| InChI |
1S/C18H18O2/c1-3-5-14-6-4-7-17(12-14)16-10-8-15(9-11-16)13(2)18(19)20/h3-4,6-13H,1,5H2,2H3,(H,19,20)
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| InChIKey |
NOUUHOHFFJKTMS-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Prostaglandin G/H synthase 1 (COX-1) | Target Info | Inhibitor | [1] |
| BioCyc | C20 prostanoid biosynthesis | |||
| KEGG Pathway | Arachidonic acid metabolism | |||
| Metabolic pathways | ||||
| Platelet activation | ||||
| Serotonergic synapse | ||||
| NetPath Pathway | TGF_beta_Receptor Signaling Pathway | |||
| Panther Pathway | Inflammation mediated by chemokine and cytokine signaling pathway | |||
| Pathwhiz Pathway | Arachidonic Acid Metabolism | |||
| WikiPathways | Prostaglandin Synthesis and Regulation | |||
| Arachidonic acid metabolism | ||||
| Phase 1 - Functionalization of compounds | ||||
| Eicosanoid Synthesis | ||||
| Selenium Micronutrient Network | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Structure-based design of COX-2 selectivity into flurbiprofen. Bioorg Med Chem Lett. 1999 Feb 8;9(3):307-12. | |||
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