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KEGG COMPOUND: C01690
<!doctype html> <html><head> <title>KEGG COMPOUND: C01690</title> <link type="text/css" rel="stylesheet" href="/css/gn2.css?1741011085"> <link type="text/css" rel="stylesheet" href="/css/bget.css?1741011085"> <meta name="viewport" content="width=device-width, initial-scale=1.0"> <link type="text/css" rel="stylesheet" href="/css/bgetm.css?1741011085" media="only screen and (max-width: 768px)"> <style>.kcfd{display:none;}</style> <script> <!-- var getElementsByClassName = document.getElementsByClassName ? function (cl){ return document.getElementsByClassName(cl); } : function (cl){ var elms = []; var objs = document.getElementsByTagName('*'); for(var i=0;i<objs.length;i++){ var obj = objs[i]; if(obj.className == cl){ elms.push(obj); } } return elms; }; function toggleField(clk,cl,show,hide){ var objs = getElementsByClassName(cl); for(var i=0;i<objs.length;i++){ var obj = objs[i]; if(!obj.style.display||obj.style.display == 'none'){ obj.style.display = 'block'; clk.innerHTML = ' « '+hide; 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form.setAttribute(key,params[key]); } else{ var obj = document.createElement('input'); obj.setAttribute('type','hidden'); obj.setAttribute('name',key); obj.setAttribute('value',params[key]); form.appendChild(obj); } } form.submit(); } window.onload=function(){window.focus();init();}; //---> </script> </head> <body> <div> <table border=0 cellpadding=0 cellspacing=0><tr><td> <table border=0 cellpadding=0 cellspacing=0 width="650"><tr><td width=70><a href="/kegg/kegg2.html"><img align="middle" alt="KEGG" border=0 src="/Fig/bget/kegg2.gif"></a></td><td> </td><td><a name="compound:C01690"></a><font class="title2">COMPOUND: C01690</font></td><td class="tar vbot"><button class="btn" onclick="javascript:void(window.open('/kegg/document/help_bget_compound.html','KEGG_Help','toolbar=no,location=no,directories=no,width=720,height=640,resizable=yes,scrollbars=yes'));return false;">Help</button></td></tr></table><form method="post" action="/entry/" enctype="application/x-www-form-urlencoded" id="form1" name="form1"></form><table class="w1" width="650"> <tr> <td class="fr2 w1"> <table width="650" class="w2"> <tr><th class="th20 deft tal vmid"><span class="nowrap">Entry</span></th> <td class="td20 defd"><table class="w1" width="100%"><tr><td class="tal pd0"><code><span class="nowrap">C01690 Compound <br> </span></code></td></tr></table></td></tr> <tr><th class="th21 deft tal vtop"><span class="nowrap">Name</span></th> <td class="td21 defd"><div class="cel"><div class="cel">Diclofenac<br> </div></div></td></tr> <tr><th class="th20 deft tal vtop"><span class="nowrap">Formula</span></th> <td class="td20 defd"><div class="cel">C14H11Cl2NO2<br> </div></td></tr> <tr><th class="th21 deft tal vtop"><span class="nowrap">Exact mass</span></th> <td class="td21 defd"><div class="cel">295.0167<br> </div></td></tr> <tr><th class="th20 deft tal vtop"><span class="nowrap">Mol weight</span></th> <td class="td20 defd"><div class="cel">296.14<br> </div></td></tr> <tr><th class="th21 deft tal vtop"><span class="nowrap">Structure</span></th> <td class="td21 defd"><a href="/Fig/compound/C01690.gif"><img name="img0" src="/Fig/compound/C01690.gif" style="max-width:600px" border=0></a><br> <button class="btn" onclick="location.href='/entry/-f+m+C01690';return false;">Mol file</button><button class="btn" onclick="location.href='/entry/-f+k+C01690';return false;">KCF file</button><button class="btn" onclick="location.href='/tools-bin/strsearch_view?ENTRY=C01690&PROGRAM=simcomp&DATABASE=compound';return false;">DB search</button></td></tr> <tr><th class="th20 deft tal vtop"><span class="nowrap">Remark</span></th> <td class="td20 defd"><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">Same as: </span></td><td><a href="/entry/D07816">D07816</a></td></tr></table></td></tr> <tr><th class="th21 deft tal vtop"><span class="nowrap">Brite</span></th> <td class="td21 defd"><div class="cel"><span class="nowrap">Anatomical Therapeutic Chemical (ATC) classification [BR:<a href="/brite/br08303+D07816">br08303</a>]<br> D DERMATOLOGICALS<br> D11 OTHER DERMATOLOGICAL PREPARATIONS<br> D11A OTHER DERMATOLOGICAL PREPARATIONS<br> D11AX Other dermatologicals<br> D11AX18 Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> M MUSCULO-SKELETAL SYSTEM<br> M01 ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS<br> M01A ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS<br> M01AB Acetic acid derivatives and related substances<br> M01AB05 Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> M02 TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN<br> M02A TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN<br> M02AA Antiinflammatory preparations, non-steroids for topical use<br> M02AA15 Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> S SENSORY ORGANS<br> S01 OPHTHALMOLOGICALS<br> S01B ANTIINFLAMMATORY AGENTS<br> S01BC Antiinflammatory agents, non-steroids<br> S01BC03 Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> USP drug classification [BR:<a href="/brite/br08302+D07816">br08302</a>]<br> Analgesics<br> Nonsteroidal Anti-inflammatory Drugs<br> Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> Ophthalmic Agents<br> Ophthalmic Anti-inflammatories<br> Nonsteroidal Anti-Inflammatory Drugs, Ophthalmic<br> Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> Risk category of Japanese OTC drugs [BR:<a href="/brite/br08312+D07816">br08312</a>]<br> Second-class OTC drugs<br> Inorganic and organic chemicals<br> Diclofenac<br> D07816 Diclofenac (USAN/INN)<br> Drug groups [BR:<a href="/brite/br08330+D07816">br08330</a>]<br> Anti-inflammatory<br> DG01504 Nonsteroidal anti-inflammatory drug (NSAID)<br> DG01906 Anti-inflammatory drug, acetic acid derivatives<br> DG01898 Anti-inflammatory drug, phenylacetic acid derivatives<br> DG00441 Diclofenac<br> D07816 Diclofenac<br> Metabolizing enzyme substrate<br> DG01642 CYP2C9 substrate<br> DG00441 Diclofenac<br> D07816 Diclofenac<br> Transporter inhibitor<br> DG02866 SLC22A8 inhibitor<br> DG00441 Diclofenac<br> D07816 Diclofenac<br> Target-based classification of drugs [BR:<a href="/brite/br08310+D07816">br08310</a>]<br> Enzymes<br> Oxidoreductases (EC1)<br> Prostaglandin synthase<br> PTGS1 (COX1)<br> D07816 Diclofenac (USAN/INN)<br> PTGS2 (COX2)<br> D07816 Diclofenac (USAN/INN)<br> Drug metabolizing enzymes and transporters [<a href="/kegg/drug/br08309.html?id=D07816">br08309.html</a>]<br> Drug metabolizing enzymes<br> D07816<br> Drug transporters<br> D07816<br> </span></div><button class="btn" onclick="location.href='/kegg-bin/search_brite?option=-a&search_string=C01690';return false;">BRITE hierarchy</button></td></tr> <tr><th class="th20 deft tal vtop"><span class="nowrap">Other DBs</span></th> <td class="td20 defd"><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">CAS: </span></td><td>15307-86-5</td></tr></table><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">PubChem: </span></td><td><a href="https://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=4831">4831</a></td></tr></table><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">ChEBI: </span></td><td><a href="https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:47381">47381</a></td></tr></table><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">PDB-CCD: </span></td><td><a href="https://www.ebi.ac.uk/pdbe-srv/pdbechem/chemicalCompound/show/DIF">DIF</a>[<a href="https://pdbj.org/mine/summary/DIF">PDBj</a>] </td></tr></table><table class="w1"><tr><td class="vtop pd0"><span class="nowrap">NIKKAJI: </span></td><td><a href="https://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J8.557J">J8.557J</a></td></tr></table></td></tr> <tr><th class="th21 deft tal vtop"><span class="nowrap">KCF data</span></th> <td class="td21 defd"><button class="btn" id="kcfb1">Show</button><div class="kcfd" id="kcfd1"><br>ATOM 19<br> 1 C8x C 26.2972 -26.1573<br> 2 C8x C 26.2972 -27.5565<br> 3 C8x C 27.5089 -28.2561<br> 4 C8x C 28.7206 -27.5565<br> 5 C8y C 28.7206 -26.1573<br> 6 C8y C 27.5089 -25.4578<br> 7 C1b C 29.9510 -25.4468<br> 8 C6a C 31.1554 -26.1420<br> 9 O6a O 32.3370 -25.4597<br> 10 O6a O 31.1558 -27.5561<br> 11 N1b N 27.5089 -24.0588<br> 12 C8y C 26.2804 -23.3494<br> 13 C8y C 26.2807 -21.9600<br> 14 C8x C 25.0692 -21.2602<br> 15 C8x C 23.8573 -21.9595<br> 16 C8x C 23.8570 -23.3489<br> 17 C8y C 25.0686 -24.0487<br> 18 X Cl 27.5049 -21.2534<br> 19 X Cl 25.0686 -25.4575<br> BOND 20<br> 1 1 2 2<br> 2 2 3 1<br> 3 3 4 2<br> 4 4 5 1<br> 5 5 6 2<br> 6 1 6 1<br> 7 5 7 1<br> 8 7 8 1<br> 9 8 9 1<br> 10 8 10 2<br> 11 6 11 1<br> 12 11 12 1<br> 13 12 13 2<br> 14 13 14 1<br> 15 14 15 2<br> 16 15 16 1<br> 17 16 17 2<br> 18 12 17 1<br> 19 13 18 1<br> 20 17 19 1<br> </div></td></tr> </table></td></tr></table> <br><span style="font-size:12px"><a href="/entry/cpd_ja:C01690">» Japanese version</a></span><br><br></td><td class="vtop"><div class="aw" style="margin-top:46px;"><div class="fm at th20"> All links </div> <div class="fm"><pre class="fm" style="margin-left:1em"> <span style="color:#006"><a href="/dbget-bin/get_linkdb?-t+5+cpd:C01690">Drug (1)</a></span> <a href="/dbget-bin/get_linkdb?-t+drug+cpd:C01690">KEGG DRUG (1)</a> <span style="color:#006"><a href="/dbget-bin/get_linkdb?-t+6+cpd:C01690">Chemical substance (21)</a></span> <a href="/dbget-bin/get_linkdb?-t+pubchem+cpd:C01690">PubChem (1)</a> <a href="/dbget-bin/get_linkdb?-t+chebi+cpd:C01690">ChEBI (1)</a> <a href="/dbget-bin/get_linkdb?-t+hmdb+cpd:C01690">HMDB (1)</a> <a href="/dbget-bin/get_linkdb?-t+hsdb+cpd:C01690">HSDB (1)</a> <a href="/dbget-bin/get_linkdb?-t+massbank+cpd:C01690">MASSBANK (15)</a> <a href="/dbget-bin/get_linkdb?-t+nikkaji+cpd:C01690">NIKKAJI (1)</a> <a href="/dbget-bin/get_linkdb?-t+pdb-ccd+cpd:C01690">PDB-CCD (1)</a> <a href="/dbget-bin/get_linkdb?-t+alldb+cpd:C01690">All databases (22)</a> <br><a href="/dbget-bin/get_linkdb?-N+cpd:C01690">Download RDF</a> </pre> </div></div> </td></tr></table> <a href="/dbget/">DBGET</a> integrated database retrieval system</div> </body> </html>