Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0AR3J
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| Former ID |
DAP000465
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| Drug Name |
Acocantherin
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| Synonyms |
Ouabain; Ouabagenin L-Rhamnoside; Ouabagenin L-rhamnoside; Acocantherin; Acocantherine; Acolongifloroside K; Astrobain; G-Strophanthin; G-Strophanthin (JAN); G-Strophicor; Gratibain; Gratus strophanthin; Kombetin; O 3125; OBN; Ouabagenin-L-rhamnosid; Ouabagenin-L-rhamnosid [German]; Ouabain (anhydrous); Ouabain anhydrous; Ouabain octahydrate; Ouabain, Octahydrate; Ouabaine; Oubain; Purostrophan; Quabain; Rectobaina; Solufantina; Strodival; Strophalen; Strophanthin G; Strophanthin-G; Strophoperm; Strophosan; Uabaina; Uabanin
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| Drug Type |
Small molecular drug
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| Indication | Atrial fibrillation [ICD-11: BC81.3; ICD-10: I48] | Approved | [1], [2] | |
| Heart failure [ICD-11: BD10-BD13] | Approved | [1], [2] | ||
| Therapeutic Class |
Cardiotonic Agents
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| Structure |
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Download2D MOL |
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| Formula |
C29H44O12
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| Canonical SMILES |
CC1C(C(C(C(O1)OC2CC(C3(C4C(CCC3(C2)O)C5(CCC(C5(CC4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O
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| InChI |
1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1
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| InChIKey |
LPMXVESGRSUGHW-HBYQJFLCSA-N
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| CAS Number |
CAS 630-60-4
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| PubChem Compound ID | ||||
| PubChem Substance ID |
4621, 598376, 7847180, 7889527, 7980210, 8011283, 10298350, 11466499, 11467619, 11486277, 11533037, 14838096, 15981102, 17405501, 24278610, 26746568, 29204593, 36883713, 46392206, 46505479, 47291380, 47736758, 48035407, 48035408, 48185244, 48334784, 49698509, 49834233, 53778049, 53787305, 57287889, 57403052, 75081902, 85182289, 85231346, 85788049, 87351514, 87575707, 90340653, 92092794, 92304198, 92308875, 95614231, 99431516, 103511767, 104038270, 104128310, 104620666, 121361712, 121404260
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| ChEBI ID |
CHEBI:472805
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| SuperDrug ATC ID |
C01AC01
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| SuperDrug CAS ID |
cas=000630604
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 4826). | |||
| REF 2 | Drug information of Ouabain, 2008. eduDrugs. | |||
| REF 3 | How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6. | |||
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