KEGG   DRUG: CaptoprilHelp
Entry
D00251                      Drug                                   

Name
Captopril (JP17/USP/INN);
Apopril (TN);
Capoten (TN)
Product
  Generic
Formula
C9H15NO3S
Exact mass
217.0773
Mol weight
217.2853
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01501  Angiotensin-converting enzyme inhibitor
 DG01925  Renin-angiotensin system inhibitor
  DG01501  Angiotensin-converting enzyme inhibitor
Remark
Same as: C06867
Therapeutic category: 2144
ATC code: C09AA01
Product: D00251<JP/US>
Product (mixture): D10276<US>
Efficacy
Antihypertensive, Angiotensin-converting enzyme inhibitor
  Disease
Hypertension [DS:H01633]
Diabetic Nephropathy [DS:H01456]
Target
ACE (CD143) [HSA:1636] [KO:K01283]
  Pathway
hsa04614  Renin-angiotensin system
Interaction
Drug interaction
Structure map
map07217  Renin-angiotensin system inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C09 AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
   C09A ACE INHIBITORS, PLAIN
    C09AA ACE inhibitors, plain
     C09AA01 Captopril
      D00251  Captopril (JP17/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Angiotensin-converting Enzyme (ACE) Inhibitors
   Captopril
    D00251  Captopril (JP17/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   214  Antihypertensives
    2144  Angiotensin converting enzyme inhibitors
     D00251  Captopril (JP17/USP/INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Peptidyl-dipeptidases
    ACE (CD143)
     D00251  Captopril (JP17/USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00251  Captopril
Prodrugs [br08324.html]
 D00251
BRITE hierarchy
Other DBs
CAS: 62571-86-2
PubChem: 7847317
ChEBI: 3380
ChEMBL: CHEMBL1560 CHEMBL162360
DrugBank: DB01197
PDB-CCD: X8Z[PDBj]
LigandBox: D00251
NIKKAJI: J3.203D
LinkDB All DBs
KCF data Show

ATOM        14
            1   C1x C    30.3001  -29.3105
            2   C1x C    30.7108  -30.6489
            3   C1x C    32.1107  -30.6718
            4   C1y C    32.5650  -29.3476
            5   N1y N    31.4460  -28.5062
            6   C5a C    31.4460  -27.1062
            7   O5a O    32.6533  -26.4091
            8   C1c C    30.2145  -26.3954
            9   C1b C    29.0237  -27.0832
            10  S1a S    27.8339  -26.3964
            11  C6a C    33.8944  -28.9394
            12  O6a O    35.2472  -29.5220
            13  O6a O    33.8637  -27.5503
            14  C1a C    30.2142  -24.9902
BOND        14
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     5   6 1
            7     6   7 2
            8     6   8 1
            9     8   9 1
            10    9  10 1
            11    4  11 1 #Down
            12   11  12 1
            13   11  13 2
            14    8  14 1 #Up

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