KEGG   DRUG: Suronacrine maleate
Entry
D05981                      Drug                                   

Name
Suronacrine maleate (USAN)
Formula
C20H20N2O. C4H4O4
Exact mass
420.1685
Mol weight
420.4578
Structure
Efficacy
Nootropic, Acetylcholinesterase inhibitor
Comment
Acridine derivative
Target
ACHE [HSA:43] [KO:K01049]
  Pathway
hsa04725  Cholinergic synapse
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Carboxylic-ester hydrolases
    ACHE
     D05981  Suronacrine maleate (USAN)
Other DBs
CAS: 113108-86-4
PubChem: 47207639
ChEMBL: CHEMBL2107302
LigandBox: D05981
NIKKAJI: J388.066D
KCF data

ATOM        31
            1   C8x C    14.0000  -16.0300
            2   C8x C    14.0000  -17.4300
            3   C8x C    15.2124  -18.1300
            4   C8y C    16.4249  -17.4300
            5   C8y C    16.4249  -16.0300
            6   C8x C    15.2124  -15.3300
            7   N5x N    17.6373  -18.1300
            8   C8y C    18.8497  -17.4300
            9   C8y C    18.8497  -16.0300
            10  C8y C    17.6373  -15.3300
            11  C1x C    20.0622  -18.1300
            12  C1x C    21.2746  -17.4300
            13  C1x C    21.2746  -16.0300
            14  C1y C    20.0622  -15.3300
            15  N1b N    17.6373  -13.9300
            16  O1a O    20.0622  -13.9303
            17  C1b C    18.8518  -13.2288
            18  C8y C    18.8529  -11.8302
            19  C8x C    20.0486  -11.1409
            20  C8x C    20.0496   -9.7409
            21  C8x C    18.8376   -9.0401
            22  C8x C    17.6418   -9.7294
            23  C8x C    17.6409  -11.1294
            24  C6a C    27.9485  -16.6462
            25  C2b C    27.2734  -15.4815
            26  O6a O    27.3489  -17.8864
            27  O6a O    29.2991  -16.6399
            28  C2b C    25.6565  -15.4877
            29  C6a C    24.9875  -16.6585
            30  O6a O    23.6369  -16.6585
            31  O6a O    25.6690  -17.8925
BOND        33
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   10  15 1
            18   14  16 1
            19   15  17 1
            20   17  18 1
            21   18  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   18  23 1
            27   24  25 1
            28   24  26 1
            29   24  27 2
            30   25  28 2
            31   28  29 1
            32   29  30 1
            33   29  31 2

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