KEGG   DRUG: Quinaprilat
Entry
D03773                      Drug                                   
Name
Quinaprilat (USAN/INN)
Formula
C23H26N2O5
Exact mass
410.1842
Mol weight
410.4629
Structure
Simcomp
Class
Cardiovascular agent
 DG01925  Renin-angiotensin system inhibitor
  DG01501  Angiotensin-converting enzyme inhibitor
 DG03231  Antihypertensive
  DG01501  Angiotensin-converting enzyme inhibitor
Remark
Same as: C21540
Efficacy
Antihypertensive, Angiotensin-converting enzyme inhibitor
Target
ACE (CD143) [HSA:1636] [KO:K01283]
  Pathway
hsa04614  Renin-angiotensin system
Interaction
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01501  Angiotensin-converting enzyme inhibitor
    D03773  Quinaprilat
  DG03231  Antihypertensive
   DG01501  Angiotensin-converting enzyme inhibitor
    D03773  Quinaprilat
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Peptidyl-dipeptidases
    ACE (CD143)
     D03773  Quinaprilat (USAN/INN)
Prodrugs [br08324.html]
 D03773
Other DBs
CAS: 85441-60-7
PubChem: 17397862
ChEBI: 140296
LigandBox: D03773
KCF data

ATOM        30
            1   C1x C    38.2900  -20.0200
            2   C8y C    39.4800  -19.3200
            3   N1y N    37.1000  -19.3200
            4   C8y C    39.4800  -17.9200
            5   C8x C    40.7400  -20.0200
            6   C1y C    37.1000  -17.9200
            7   C1x C    38.2900  -17.2200
            8   C8x C    40.7400  -17.2200
            9   C8x C    41.9300  -19.3200
            10  C8x C    41.9300  -17.9200
            11  N1b N    33.4600  -20.0200
            12  C1c C    32.2700  -19.3200
            13  C6a C    32.2700  -17.9200
            14  C1b C    31.0100  -20.0200
            15  O6a O    33.4600  -17.2200
            16  O6a O    31.0100  -17.2200
            17  C1b C    29.8200  -19.3200
            18  C8y C    28.6300  -20.0200
            19  C8x C    28.6300  -21.4200
            20  C8x C    27.3700  -19.3200
            21  C8x C    27.3700  -22.1200
            22  C8x C    26.1800  -20.0200
            23  C8x C    26.1800  -21.4200
            24  C1c C    34.6500  -19.3200
            25  C5a C    35.8400  -20.0200
            26  O5a O    35.8400  -21.4200
            27  C1a C    34.6500  -17.9200
            28  C6a C    37.1000  -16.5200
            29  O6a O    38.2900  -15.7500
            30  O6a O    35.8400  -15.8200
BOND        32
            1     6   7 1
            2     9  10 1
            3     1   2 1
            4     1   3 1
            5    11  12 1
            6    12  13 1 #Up
            7    12  14 1
            8    13  15 1
            9    13  16 2
            10   14  17 1
            11   17  18 1
            12   18  19 1
            13   18  20 2
            14   19  21 2
            15   20  22 1
            16   21  23 1
            17   22  23 2
            18    2   4 2
            19   11  24 1
            20    2   5 1
            21   24  25 1
            22   25   3 1
            23    3   6 1
            24   25  26 2
            25    4   7 1
            26   24  27 1 #Up
            27    4   8 1
            28    6  28 1 #Down
            29    5   9 2
            30   28  29 1
            31    8  10 2
            32   28  30 2

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Ontology (3)   
   KEGG BRITE (3)   
Drug (2)   
   KEGG DGROUP (1)   
   LigandBox (1)   
Chemical substance (4)   
   KEGG COMPOUND (1)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
Gene (2)   
   KEGG ORTHOLOGY (1)   
   KEGG GENES (1)   
All databases (11)   

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