EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:65513 - brasilicardin A
| Formula | C45H68N2O16 |
| Net Charge | 0 |
| Average Mass | 893.037 |
| Monoisotopic Mass | 892.45688 |
| SMILES | [H][C@@]1(O[C@H]2[C@@H](O)[C@H](O[C@@]3([H])C[C@@]4(C)[C@@]5([H])CC=C(C)[C@@H](C[C@H](OC)[C@H](N)C(=O)O)[C@]5(C)CC[C@]4([H])C(C)(C)[C@@H]3O)O[C@@H](C)[C@@H]2OC(=O)c2cccc(O)c2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O |
| InChI | InChI=1S/C45H68N2O16/c1-20-12-13-30-44(6,25(20)17-26(58-8)31(46)39(55)56)15-14-29-43(4,5)38(54)27(18-45(29,30)7)60-42-35(53)37(36(21(2)59-42)62-40(57)23-10-9-11-24(50)16-23)63-41-32(47-22(3)49)34(52)33(51)28(19-48)61-41/h9-12,16,21,25-38,41-42,48,50-54H,13-15,17-19,46H2,1-8H3,(H,47,49)(H,55,56)/t21-,25+,26-,27-,28+,29+,30-,31-,32+,33+,34+,35+,36-,37-,38+,41-,42-,44-,45+/m0/s1 |
| InChIKey | SAZHWKBRJJLWKC-YFSQLXLCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nocardia brasiliensis (ncbitaxon:37326) | - | PubMed (10092191) | Strain: IFM0406 |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Roles: | bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. 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. mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| Applications: | 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. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| brasilicardin A (CHEBI:65513) has role antimicrobial agent (CHEBI:33281) |
| brasilicardin A (CHEBI:65513) has role antineoplastic agent (CHEBI:35610) |
| brasilicardin A (CHEBI:65513) has role bacterial metabolite (CHEBI:76969) |
| brasilicardin A (CHEBI:65513) has role immunosuppressive agent (CHEBI:35705) |
| brasilicardin A (CHEBI:65513) is a N-acetyl-D-glucosaminide (CHEBI:28401) |
| brasilicardin A (CHEBI:65513) is a benzoate ester (CHEBI:36054) |
| brasilicardin A (CHEBI:65513) is a carbotricyclic compound (CHEBI:38032) |
| brasilicardin A (CHEBI:65513) is a diterpenoid (CHEBI:23849) |
| brasilicardin A (CHEBI:65513) is a non-proteinogenic α-amino acid (CHEBI:83925) |
| brasilicardin A (CHEBI:65513) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| 8638849 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| Reaxys:8534969 | Reaxys |
| Citations |
|---|