EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:168396 - mycophenolic acid
| Formula | C17H20O6 |
| Net Charge | 0 |
| Average Mass | 320.341 |
| Monoisotopic Mass | 320.12599 |
| SMILES | COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O)C(=O)OC2 |
| InChI | InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+ |
| InChIKey | HPNSFSBZBAHARI-RUDMXATFSA-N |
| Wikipedia |
|---|
| Roles Classification |
|---|
| Chemical Roles: | environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects. Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Roles: | xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. anticoronaviral agent Any antiviral agent which inhibits the activity of coronaviruses. mycotoxin Poisonous substance produced by fungi. immunosuppressive agent An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response. antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. EC 1.1.1.205 (IMP dehydrogenase) inhibitor An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD+ or NADP+ acceptor) inhibitor that interferes with the action of IMP dehydrogenase (EC 1.1.1.205), so blocking de novo biosynthesis of purine nucleotides. Penicillium metabolite Any fungal metabolite produced during a metabolic reaction in Penicillium. antiviral agent A substance that destroys or inhibits replication of viruses. |
| Applications: | hypoglycemic agent A drug which lowers the blood glucose level. antifibrotic agent Any agent which acts to reduce fibrosis. immunosuppressive agent An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response. anti-inflammatory agent Any compound that has anti-inflammatory effects. ophthalmology drug Any compound used for the treatment of eye conditions or eye diseases. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| mycophenolic acid (CHEBI:168396) has functional parent hex-4-enoic acid (CHEBI:38355) |
| mycophenolic acid (CHEBI:168396) has role Penicillium metabolite (CHEBI:76964) |
| mycophenolic acid (CHEBI:168396) has role anti-inflammatory agent (CHEBI:67079) |
| mycophenolic acid (CHEBI:168396) has role anticoronaviral agent (CHEBI:149553) |
| mycophenolic acid (CHEBI:168396) has role antifibrotic agent (CHEBI:233423) |
| mycophenolic acid (CHEBI:168396) has role antimicrobial agent (CHEBI:33281) |
| mycophenolic acid (CHEBI:168396) has role antineoplastic agent (CHEBI:35610) |
| mycophenolic acid (CHEBI:168396) has role antiviral agent (CHEBI:22587) |
| mycophenolic acid (CHEBI:168396) has role EC 1.1.1.205 (IMP dehydrogenase) inhibitor (CHEBI:53746) |
| mycophenolic acid (CHEBI:168396) has role environmental contaminant (CHEBI:78298) |
| mycophenolic acid (CHEBI:168396) has role hypoglycemic agent (CHEBI:35526) |
| mycophenolic acid (CHEBI:168396) has role immunosuppressive agent (CHEBI:35705) |
| mycophenolic acid (CHEBI:168396) has role mycotoxin (CHEBI:25442) |
| mycophenolic acid (CHEBI:168396) has role ophthalmology drug (CHEBI:66981) |
| mycophenolic acid (CHEBI:168396) has role xenobiotic (CHEBI:35703) |
| mycophenolic acid (CHEBI:168396) is a 2-benzofurans (CHEBI:38831) |
| mycophenolic acid (CHEBI:168396) is a monocarboxylic acid (CHEBI:25384) |
| mycophenolic acid (CHEBI:168396) is a phenols (CHEBI:33853) |
| mycophenolic acid (CHEBI:168396) is a γ-lactone (CHEBI:37581) |
| mycophenolic acid (CHEBI:168396) is conjugate acid of mycophenolate (CHEBI:62932) |
| Incoming Relation(s) |
| mycophenolate mofetil (CHEBI:8764) has functional parent mycophenolic acid (CHEBI:168396) |
| mycophenolic acid O-acyl-glucuronide (CHEBI:64689) has functional parent mycophenolic acid (CHEBI:168396) |
| mycophenolate (CHEBI:62932) is conjugate base of mycophenolic acid (CHEBI:168396) |
| IUPAC Name |
|---|
| (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid |
| INNs | Source |
|---|---|
| acide mycophenolique | ChemIDplus |
| acido micofenolico | ChemIDplus |
| acidum mycophenolicum | ChemIDplus |
| mycophenolic acid | KEGG DRUG |
| Synonyms | Source |
|---|---|
| 68618 | ChEMBL |
| (E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid | ChemIDplus |
| Micofenolico acido | ChemIDplus |
| Mycophenolate | ChemIDplus |
| Mycophenolate mofetil impurity, mycophenolic acid- | ChEMBL |
| Mycophenolsäure | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Reaxys:318158 | Reaxys |
| CAS:24280-93-1 | DrugBank |
| CAS:24280-93-1 | ChemIDplus |
| CAS:24280-93-1 | KEGG DRUG |
| Citations |
|---|