Drugs Information: Digitoxin
Basic Information
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| ID | DDInter553 | |
| Drug Type | small molecule | |
| Molecular Formula | C41H64O13 | |
| Molecular Weight | 764.950 | |
| Description | Digitoxin is a cardiac glycoside used in the treatment and management of congestive cardiac insufficiency, arrhythmias and heart failure. | |
| ATC Classification | C01AA04 | |
| IUPAC Name | 4-[(1R,3As,3Br,5Ar,7S,9As,9Bs,11Ar)-7-{[(2R,4S,5S,6R)-5-{[(2S,4S,5S,6R)-5-{[(2S,4S,5S,6R)-4,5-Dihydroxy-6-Methyloxan-2-Yl]Oxy}-4 | |
| InChI | Inchi=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 | |
| InChI Key | WDJUZGPOPHTGOT-XUDUSOBPSA-N | |
| Canonical SMILES | [H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](O)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1)C1=CC(=O)OC1 | |
| Useful Links | DrugBank ChEMBL PubChem | |
Interactions with Digitoxin
| Severity level | ID | Name | Mechanism | Detail |
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