Therapeutic Targets Database
BIDD Pharmainformatics Databases
 
   
   

 

TTD Drug ID: DAP000909

Drug Information
NameDeserpidine
SynonymsORETICYL 50; Deserpidic acid, methyl ester, 3,4,5-trimethoxybenzoate; methyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate; Deserpidinum; Recanescin; Deserpidin; CHEMBL1200515; A-11025; Deserpidina; Recanescine; Halmonyl; Benz[g]indolo[2,3-a]quinolizine-1-carboxylic acid, 1,2,3,4,4a,5,7,8,-13,13b,14,14a-dodecahydro-3-hydroxy-2-methoxy-, methyl ester, 3,4,5-trimethoxybenzoate; C06541; 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-17-alpha-methoxy-, methyl ester, 3,4,5-trimethoxybenzoate (ester); Deserpidine (INN); Methyl 18beta-hydroxy-17alpha-methoxy-3beta,20alpha-yohimban-16beta-carboxylate, 3,4,5-trimethoxybenzoate (ester); Tranquinil; EINECS 205-004-8; LS-7299; BRN 0101820; (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester; Deserpidinum [INN-Latin]; Lilly 22641; Desmethoxyreserpine; Methyl 17alpha-methoxy-18beta-((3,4,5-trimethoxybenzoyl)oxy)-3beta,20alpha-yohimban-16beta-carboxylate; CHEBI:27478; 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-17-alpha-methoxy-,methyl ester, 3,4,5-trimethoxybenzoate (ester); MD-0232; CID8550; D08194; Halmonyl (TN); AC1Q5YIY; Canescine; Raunormine; NCGC00168786-01; I06-1877; NSC72138; 11-Demethoxyreserpine; 11-Desmethoxyreserpine; UNII-9016E3VB47; Desepridine; Deserpidina [INN-Spanish]; Deserpidine [INN:BAN]; NCGC00168786-02; 17.alpha.-Methoxy-18.beta.-[(3,4,5-trimethoxybenzoyl)oxy]-3.beta.,20.alpha.-yohimban-16.beta.-carboxylic acid methyl ester; Methyl 17alpha-methoxy-18beta-(3,4,5-trimethoxybenzoyloxy)-3beta,20alpha-yohimban-16beta-carboxylat; DB01089; methyl (3beta,16beta,17alpha,18beta,20alpha)-17-(methyloxy)-18-({[3,4,5-tris(methyloxy)phenyl]carbonyl}oxy)yohimban-16-carboxylate; Yohimban-16-carboxylic acid, 17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-, methyl ester, (3b,16b,17a,18b,20a)-; C32H38N2O8; Raunormin; DESERPIDINE; Reserpidine; AR-1I3653; Deresperine; Canescin; Harmonyl; 131-01-1; 4-25-00-01282 (Beilstein Handbook Reference); NSC 72138; AC1L1R81; 959244-16-7
IndicationHypertension
[ICD9: 401   ICD10: I10, I11, I12, I13, I15]
Approved    [1]
Structure

Click to save drug structure in 3D MOL format

Click to save drug structure in 2D MOL format
InChI1S/C32H38N2O8/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14
-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30
(26)40-4)32(36)41-5/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H
2,1-5H3/t18-,21+,23-,26-,27+,30+/m1/s1
InChIKeyCVBMAZKKCSYWQR-WCGOZPBSSA-N
Canonical SMILESCOC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)
OC)OC    
Isomeric SMILESCO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=CC=CC=
C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC
Therapeutic ClassAntihypertensive Agents
CAS NumberCAS 131-01-1
FormulaC32H38N2O8
PubChem Compound IDCID 8550.
PubChem Substance IDSID 8771.
ChEBI27478;
SuperDrug ATC IDC02AA05
SuperDrug CAS ID000131011;
TargetAngiotensin-converting enzymeInhibitor[2][3]
Ref 1FDA Approved Drug Products from FDA Official Website. 2009. Application Number: (NDA) 010796 To Reference
Ref 2Angiotensin II-induced modulation of endothelium-dependent relaxation in rabbit mesenteric resistance arteries. J Physiol. 2003 May 1;548(Pt 3):893-906. Epub 2003 Mar 21. To Reference
Ref 3Drug interaction exposures in an ambulatory Medicaid population. Am J Hosp Pharm. 1979 Jul;36(7):923-7. To Reference



 

Welcome to sign our Guestbook.

If you find any error in data or bug in web service, please kindly report it to Dr. Zhu.


Dr. Chen Yuzong
Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543