EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:65457 - astragaloside IV
| Formula | C41H68O14 |
| Net Charge | 0 |
| Average Mass | 784.981 |
| Monoisotopic Mass | 784.46091 |
| SMILES | [H][C@@]1(O[C@H]2C[C@@]3([H])[C@]4(C)C[C@H](O)[C@]([H])([C@@]5(C)CC[C@@H](C(C)(C)O)O5)[C@@]4(C)CC[C@]34C[C@@]43CC[C@H](O[C@]4([H])OC[C@@H](O)[C@H](O)[C@H]4O)C(C)(C)[C@]23[H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C41H68O14/c1-35(2)24(54-33-29(48)26(45)20(44)17-51-33)9-11-41-18-40(41)13-12-37(5)31(39(7)10-8-25(55-39)36(3,4)50)19(43)15-38(37,6)23(40)14-21(32(35)41)52-34-30(49)28(47)27(46)22(16-42)53-34/h19-34,42-50H,8-18H2,1-7H3/t19-,20+,21-,22+,23-,24-,25-,26-,27+,28-,29+,30+,31-,32-,33-,34+,37+,38-,39+,40-,41+/m0/s1 |
| InChIKey | QMNWISYXSJWHRY-YLNUDOOFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Astragalus membranaceus (ncbitaxon:649199) | root (BTO:0001188) | DOI (10.1021/np50075a009) |
| Roles Classification |
|---|
| Chemical Role: | antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. |
| Biological Roles: | EC 4.2.1.1 (carbonic anhydrase) inhibitor An EC 4.2.1.* (hydro-lyases) inhibitor that interferes with the action of carbonic anhydrase (EC 4.2.1.1). Such compounds reduce the secretion of H+ ions by the proximal kidney tubule. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| Applications: | anti-inflammatory agent Any compound that has anti-inflammatory effects. neuroprotective agent Any compound that can be used for the treatment of neurodegenerative disorders. pro-angiogenic agent Any compound that promotes the growth of new blood vessels from pre-existing vessels. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| astragaloside IV (CHEBI:65457) has functional parent cycloastragenol (CHEBI:71314) |
| astragaloside IV (CHEBI:65457) has role anti-inflammatory agent (CHEBI:67079) |
| astragaloside IV (CHEBI:65457) has role antioxidant (CHEBI:22586) |
| astragaloside IV (CHEBI:65457) has role EC 4.2.1.1 (carbonic anhydrase) inhibitor (CHEBI:23018) |
| astragaloside IV (CHEBI:65457) has role neuroprotective agent (CHEBI:63726) |
| astragaloside IV (CHEBI:65457) has role plant metabolite (CHEBI:76924) |
| astragaloside IV (CHEBI:65457) has role pro-angiogenic agent (CHEBI:72571) |
| astragaloside IV (CHEBI:65457) is a pentacyclic triterpenoid (CHEBI:25872) |
| astragaloside IV (CHEBI:65457) is a triterpenoid saponin (CHEBI:61778) |
| Synonyms | Source |
|---|---|
| 3-O-β-D-xylopyranosyl-6-O-β-D-glucopyranosylcycloastragenol | ChEBI |
| Cyclosiversioside F | ChemIDplus |
| Astragaloside A | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Reaxys:5720375 | Reaxys |
| CAS:83207-58-3 | ChemIDplus |
| Citations |
|---|