KEGG   DRUG: Delapril
Entry
D07781                      Drug                                   
Name
Delapril (INN);
Delaket (TN)
Formula
C26H32N2O5
Exact mass
452.2311
Mol weight
452.5427
Structure
Simcomp
Class
Cardiovascular agent
 DG01925  Renin-angiotensin system inhibitor
  DG01501  Angiotensin-converting enzyme inhibitor
 DG03231  Antihypertensive
  DG01501  Angiotensin-converting enzyme inhibitor
Remark
ATC code: C09AA12
Chemical structure group: DG00343
Product (DG00343): D01667<JP>
Efficacy
Antihypertensive, Angiotensin-converting enzyme inhibitor
Comment
Active form of prodrug: Delaprilat [CPD:C21575]
Target
ACE (CD143) [HSA:1636] [KO:K01283]
  Pathway
hsa04614  Renin-angiotensin system
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
     C09AA12 Delapril
      D07781  Delapril (INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01501  Angiotensin-converting enzyme inhibitor
    DG00343  Delapril
     D07781  Delapril
  DG03231  Antihypertensive
   DG01501  Angiotensin-converting enzyme inhibitor
    DG00343  Delapril
     D07781  Delapril
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Peptidyl-dipeptidases
    ACE (CD143)
     D07781  Delapril (INN)
Prodrugs [br08324.html]
 D07781
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01501  Angiotensin-converting enzyme inhibitor
    DG00343  Delapril
  DG03231  Antihypertensive
   DG01501  Angiotensin-converting enzyme inhibitor
    DG00343  Delapril
Prodrugs [br08324.html]
 DG00343
Other DBs
CAS: 83435-66-9
PubChem: 96024479
LigandBox: D07781
NIKKAJI: J239.643B
LinkDB
KCF data

ATOM        33
            1   N1c N    25.8300  -18.2000
            2   C1b C    25.8300  -16.8000
            3   N1b N    22.2600  -18.9000
            4   C1c C    21.0000  -18.2000
            5   C7a C    21.0000  -16.8000
            6   C1b C    19.8100  -18.9000
            7   O6a O    22.2600  -16.1000
            8   O7a O    19.8100  -16.1000
            9   C1b C    18.5500  -18.2000
            10  C8y C    17.3600  -18.9000
            11  C8x C    17.3600  -20.3000
            12  C8x C    16.1700  -18.2000
            13  C8x C    16.1700  -21.0000
            14  C8x C    14.9100  -18.9000
            15  C8x C    14.9100  -20.3000
            16  C1c C    23.4500  -18.2000
            17  C5a C    24.6400  -18.9000
            18  O5a O    24.6400  -20.3000
            19  C1a C    23.4500  -16.8000
            20  C6a C    27.0900  -16.1000
            21  O6a O    27.0900  -14.7000
            22  O6a O    28.2800  -16.8000
            23  C1y C    27.0900  -18.7600
            24  C8y C    29.4000  -18.7600
            25  C8y C    28.9800  -20.0900
            26  C8x C    29.8200  -21.1400
            27  C8x C    31.2200  -20.8600
            28  C8x C    31.6400  -19.5300
            29  C8x C    30.7300  -18.4800
            30  C1x C    27.5800  -20.0900
            31  C1x C    28.2100  -17.9200
            32  C1b C    18.5500  -16.8000
            33  C1a C    17.3600  -16.1000
BOND        35
            1    10  12 2
            2    11  13 2
            3    12  14 1
            4    13  15 1
            5    14  15 2
            6     3  16 1
            7    16  17 1
            8    17   1 1
            9    17  18 2
            10   16  19 1 #Up
            11    1   2 1
            12    2  20 1
            13   20  21 2
            14    3   4 1
            15   20  22 1
            16    4   5 1 #Up
            17    1  23 1
            18    4   6 1
            19    5   7 2
            20    5   8 1
            21    6   9 1
            22    9  10 1
            23   24  25 2
            24   25  26 1
            25   26  27 2
            26   27  28 1
            27   28  29 2
            28   29  24 1
            29   10  11 1
            30   23  30 1
            31   30  25 1
            32   24  31 1
            33   31  23 1
            34    8  32 1
            35   32  33 1

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