KEGG   DRUG: Sacubitril
Entry
D10225                      Drug                                   
Name
Sacubitril (JAN/USAN/INN)
Formula
C24H29NO5
Exact mass
411.2046
Mol weight
411.4908
Structure
Efficacy
Antihypertensive, Neprilysin inhibitor
Comment
Treatment of cardiovascular disease
Target
MME (CD10) [HSA:4311] [KO:K01389]
  Pathway
hsa04614  Renin-angiotensin system
hsa04640  Hematopoietic cell lineage
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Metallo peptidases
    MME (CD10)
     D10225  Sacubitril (JAN/USAN/INN)
Other DBs
CAS: 149709-62-6
PubChem: 163312256
KCF data

ATOM        30
            1   C1a C    35.1400  -21.3500
            2   C1b C    33.8800  -20.6500
            3   O7a O    32.6900  -21.3500
            4   C7a C    31.5000  -20.6500
            5   C1c C    30.3100  -21.3500
            6   O6a O    31.5000  -19.1800
            7   C1b C    29.1200  -20.6500
            8   C1c C    27.9300  -21.3500
            9   N1b N    26.6700  -20.6500
            10  C5a C    25.4800  -21.3500
            11  C1b C    24.2900  -20.6500
            12  O5a O    25.4800  -22.7500
            13  C1b C    23.1000  -21.3500
            14  C6a C    21.9100  -20.6500
            15  O6a O    20.7200  -21.3500
            16  O6a O    21.9100  -19.1800
            17  C1b C    27.9472  -22.7499
            18  C1a C    30.3100  -22.7500
            19  C8y C    29.1551  -23.8476
            20  C8x C    28.4417  -25.0532
            21  C8x C    29.1265  -26.3444
            22  C8y C    30.5264  -26.2919
            23  C8x C    31.2486  -25.0764
            24  C8x C    30.5638  -23.8553
            25  C8y C    31.2523  -27.5132
            26  C8x C    30.5618  -28.7456
            27  C8x C    31.2773  -29.9489
            28  C8x C    32.6772  -29.9309
            29  C8x C    33.3677  -28.6985
            30  C8x C    32.6522  -27.4952
BOND        31
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     4   6 2
            6     5   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12   11  13 1
            13   13  14 1
            14   14  15 1
            15   14  16 2
            16    8  17 1 #Up
            17    5  18 1 #Down
            18   17  19 1
            19   19  20 2
            20   20  21 1
            21   21  22 2
            22   22  23 1
            23   23  24 2
            24   19  24 1
            25   22  25 1
            26   25  26 2
            27   26  27 1
            28   27  28 2
            29   28  29 1
            30   29  30 2
            31   25  30 1

» Japanese version   » Back

  All links  
Ontology (1)   
   KEGG BRITE (1)   
Chemical substance (1)   
   PubChem (1)   
Gene (2)   
   KEGG ORTHOLOGY (1)   
   KEGG GENES (1)   
All databases (4)   

Download RDF
DBGET integrated database retrieval system