d
digitoxin
Chemical compound
Also known as digitoxoside · unidigin · Crystodigin (TN) · Digitoxin · Digitoxinum · Digitoxoside
- Formula
- C₄₁H₆₄O₁₃
1
- C₄₁H₆₄O₁₃
- Mass
- 764.4347 Da
1
- 764.4347 Da
Overview
Chemistry
All data
87 statements · 56% with external sources · numbers in brackets are citations
- Medical condition treated
- atrial fibrillation
1
- congestive heart failure
1
- supraventricular tachycardia
1
- congestive heart failure approved by: United States Food and Drug Administration
1
Sources- 1.Stated in Inxight: Drugs Databasedrugs.ncats.io/drug/E90NZP2L9URetrieved 2018-11-02
- atrial fibrillation
- Isomeric SMILES
- C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)C)C)C)O)O
1
- C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)C)C)C)O)O
- Canonical SMILES
- CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O
1
- CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O
- Subject has role
- enzyme inhibitor
2
Sources- 1.Stated in NDF-RTRetrieved 2018-03-05
- 2.Stated in Medical Subject HeadingsRetrieved 2018-03-15
- antiarrhythmic agent
1
- cardiotonic
1
- enzyme inhibitor
- Physically interacts with
- ATPase Na+/K+ transporting subunit alpha 1 subject has role: enzyme inhibitor
1
- ATPase Na+/K+ transporting subunit alpha 1 subject has role: enzyme inhibitor
- Found in taxon
- Digitalis purpurea
11
Sources- 1.Stated in Quantitative Determination of Digitalis Glycosides inDigitalis PurpureaLeaves by Reversed-Phase Thin-Layer Chromatography
- 2.Stated in Biosynthesis of digitoxin in Digitalis purpurea
- 3.Stated in Search for New Drugs of Plant Origin
- 4.Stated in Biosynthesis of the butenolide ring of cardenolides in Digitalis purpurea
- 5.Stated in Quantitative Hplc Analysis of Cardiac Glycosides in Digitalis purpurea Leaves
- 6.Stated in Digitoxin Biosynthesis in Isolated Mesophyll Cells and Cultured Cells of <italic>Digitalis</italic>
- Digitalis ciliata
2
Sources- 1.Stated in Gitaloxin fromDigitalis ciliata
- 2.Stated in Cardiac glycosides from the seeds ofDigitalis ciliata
- Digitalis obscura
2
Sources- 1.Stated in Cardenolides of Digitalis obscura: The effect of phosphate and manganese on growth and productivity of shoot-tip cultures
- 2.Stated in Digitalis obscura cardenolides. Effect of macronutrient concentration and N source on growth and productivity of shoot-tip cultures
- Digitalis grandiflora
- Digitalis parviflora
- Digitalis viridiflora
- Digitalis lanata
9
Sources- 1.Stated in Long-Term Cultivation of Digitalis lanata Clones Propagated in Vitro: Cardenolide Content of the Regenerated Plants1.
- 2.Stated in The production of secondary metabolites by Digitalis lanata during CO2 enrichment and water stress
- 3.Stated in Quantitative determination of cardiac glycosides in Digitalis lanata leaves by reversed-phase thin-layer chromatography
- 4.Stated in Variation of cardenolides with growth in a Digitalis lanata Brazilian cultivar
- 5.Stated in Determination of some cardiac glycosides by high-performance liquid chromatography
- 6.Stated in Acetyl coenzyme A: Digitoxin 15′-O-acetyltransferase from Digitalis plants and suspension cultures
- Digitalis purpurea
- Defined daily dose
- 0.1 milligram route of administration: oral administration
- 0.1 milligram route of administration: parenteral route of administration
On other databases
53 identifiers linking digitoxin across the web's reference databases
- ATC codeC01AA04
- CAMEO Chemicals ID4954
- CAS Registry Number71-63-6
- ChEBI ID28544
- ChEMBL IDCHEMBL254219
- ChemSpider ID389987
- DrugBank IDDB01396
- DrugCentral ID881
- DSSTOX compound identifierDTXCID102933
- DSSTox substance IDDTXSID0022933
- EC number200-760-5
- ECHA Substance Infocard ID100.000.691
- Electronic Essential Medicines List medicine ID499
- Elhuyar ZTH ID022371
- Encyclopædia Britannica Online IDscience/digitoxin
- Encyclopædia Universalis IDdigitaline
- Encyclopedia of China (Third Edition) ID (2026)2gvkWd
- Encyclopedia of China (Third Edition) old ID (2021)449203
- Freebase ID/m/01xc6w
- Great Norwegian Encyclopedia IDdigitoksin
- Guide to Pharmacology Ligand ID6782
- HCIS ID1369
- HSDB ID215
- Human Metabolome Database IDHMDB0015468
- InChIInChI=1S/C41H64O13/c1-20-36(46)29(42)16-34(49-20)53-38-22(3)51-35(18-31(38)44)54-37-21(2)50-33(17-30(37)43)52-25-8-11-39(4)24(15-25)6-7-28-27(39)9-12-40(5)26(10-13-41(28,40)47)23-14-32(45)48-19-23/h14,20-22,24-31,33-38,42-44,46-47H,6-13,15-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27+,28-,29+,30+,31+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1
- InChIKeyWDJUZGPOPHTGOT-XUDUSOBPSA-N
- JSTOR topic ID (archived)digitoxins
- KEGG IDD00297
- KNApSAcK IDC00003617
- LIPID MAPS IDLMST01120018
- MassBank accession IDMSBNK-Waters-WA000565
- MeSH concept IDM0006383
- MeSH descriptor IDD004074
- MeSH tree codeD04.210.500.155.580.130.500.336
- Microsoft Academic ID (discontinued)2780628665
- NDF-RT IDN0000145817
- NSC number7529
- OpenAlex IDC2780628665
- PDB ligand IDF9R
- Probes And Drugs IDPD009517
- PubChem CID441207
- Reaxys registry number76678
- Römpp online IDRD-04-01495
- RxNorm CUI3403
- SPLASHsplash10-052f-0000038900-ce876c40fbc729e75343
- SureChEMBL ID20940
- UMLS CUIC0012258
- UniChem compound ID152336
- UNIIE90NZP2L9U
- Wellcome Collection concept IDeywpzmje
- WikiProjectMed IDDigitoxin
- WordNet 3.1 Synset ID03202350-n
- ZVG number36190