KEGG   DRUG: D06288Help
Entry
D06288                      Drug                                   

Name
Velnacrine maleate (USAN);
Mentane (TN)
Formula
C13H14N2O. C4H4O4
Exact mass
330.1216
Mol weight
330.3352
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Inhibitor [cholinesterase]
Target
acetylcholinesterase (AChE) inhibitor [HSA:43] [KO:K01049]
  Pathway
hsa00564  Glycerophospholipid metabolism
hsa04725  Cholinergic synapse  
 
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   acetylcholinesterase (AChE)
    Velnacrine
     D06288  Velnacrine maleate (USAN)
BRITE hierarchy
Other DBs
CAS: 
118909-22-1
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C8x C     5.5300  -17.9200
            2   C8x C     5.5300  -19.3200
            3   C8x C     6.7424  -20.0200
            4   C8y C     7.9549  -19.3200
            5   C8y C     7.9549  -17.9200
            6   C8x C     6.7424  -17.2200
            7   N5x N     9.1673  -20.0200
            8   C8y C    10.3797  -19.3200
            9   C8y C    10.3797  -17.9200
            10  C8y C     9.1673  -17.2200
            11  C1x C    11.5922  -20.0200
            12  C1x C    12.8046  -19.3200
            13  C1x C    12.8046  -17.9200
            14  C1y C    11.5922  -17.2200
            15  N1a N     9.1673  -15.8200
            16  O1a O    11.5922  -15.8203
            17  C6a C    19.5485  -18.6062
            18  C2b C    18.8734  -17.4415
            19  O6a O    18.9489  -19.8464
            20  O6a O    20.8991  -18.5999
            21  C2b C    17.2565  -17.4477
            22  C6a C    16.5875  -18.6185
            23  O6a O    15.2369  -18.6185
            24  O6a O    17.2690  -19.8525
BOND        25
            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   17  18 1
            20   17  19 1
            21   17  20 2
            22   18  21 2
            23   21  22 1
            24   22  23 1
            25   22  24 2

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