Compound Description
| ID: C0019 | Common name: Digitoxin |
| IUPAC: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one | CAS: CAS:71-63-6 |
| Chembl ID: CHEMBL254219 | Pubchem ID: CID:441207 |
| Formula: C41H64O13 | TCM-ID: TCMC1042 |
| Smiles: O=C1OCC(=C1)[C@H]1CC[C@]2([C@]1(C)CC[C@H]1[C@H]2CC[C@H]2[C@]1(C)CC[C@@H](C2)O[C@H]1C[C@H](O)[C@@H]([C@H](O1)C)O[C@H]1C[C@H](O)[C@@H]([C@H](O1)C)O[C@H]1C[C@H](O)[C@@H]([C@H](O1)C)O)O | |
| Alias:
Digitoxin;
Digitoxoside; (3β,5β)-3-[(O-2,6-Dideoxy-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-14-hydroxycard-20(22)-enolide; Cardidigin; Cardigin; Carditoxin; Coramedan; Cristapurat; Crystalline digitalin; Crystodigin; Digicor; Digilong; Digimed; Digimerck; Digipural; Digisidin; Digitaline Nativelle; Digitophyllin; Digitoxigenin tridigitoxoside; Digitrin; Ditaven; Glucodigin; Lanatoxin; Myodigin; NSC 7529; Purodigin; Purpurid; Tradigal; Unidigin |
Structure:
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Related Targets (Total: 1)
| Target id | Protein Name | Gene Symbol | Uniprot ID | Target Level | No.of Literature Evidence |
|---|---|---|---|---|---|
| T96JGO | Solute carrier organic anion transporter family member 1B1 | SLCO1B1 |
Q9Y6L6 |
A | 1 Reference(s) |
*In this table, target level represents the quality confidence indicators of targets.
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".
Related Herbs (Total: 2)
Ckey description of the interaction between compound and target