KEGG   COMPOUND: C05721
Entry
C05721                      Compound                               
Name
Leucomethylene blue;
Reduced methylene blue
Formula
C16H19N3S
Exact mass
285.13
Mol weight
285.4072
Structure
Remark
Same as: D11427
Comment
Methylene blue [CPD:C00220]
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Cytoskeleton
    MAPT (TAU)
     D11427  Hydromethylthionine (USAN/INN)
Other DBs
CAS: 613-11-6
PubChem: 8026
ChEBI: 134180
KCF data

ATOM        20
            1   C8y C    20.8847  -16.2077
            2   C8y C    20.8847  -14.8803
            3   S2x S    22.1423  -17.1160
            4   C8x C    19.6970  -16.9064
            5   N1x N    22.1423  -14.1117
            6   C8x C    19.6970  -14.1816
            7   C8y C    23.3301  -16.2077
            8   C8y C    18.5092  -16.2077
            9   C8y C    23.3301  -14.8104
            10  C8x C    18.5092  -14.8803
            11  C8x C    24.5877  -16.9064
            12  N1c N    17.3215  -16.9064
            13  C8x C    24.5178  -14.1117
            14  C8y C    25.7754  -16.2077
            15  C1a C    16.1338  -16.2077
            16  C1a C    17.3215  -18.3038
            17  C8x C    25.7754  -14.8104
            18  N1c N    26.9632  -16.9064
            19  C1a C    26.9632  -18.3038
            20  C1a C    28.1509  -16.2077
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     6  10 2
            10    7  11 1
            11    8  12 1
            12    9  13 1
            13   11  14 2
            14   12  15 1
            15   12  16 1
            16   13  17 2
            17   14  18 1
            18   18  19 1
            19   18  20 1
            20    7   9 2
            21    8  10 1
            22   14  17 1

» Japanese version

  All links  
Drug (1)   
   KEGG DRUG (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (3)   

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