KEGG   DRUG: Molsidomine
Entry
D01320                      Drug                                   
Name
Molsidomine (JAN/USAN/INN)
Formula
C9H14N4O4
Exact mass
242.1015
Mol weight
242.2319
Structure
Remark
ATC code: C01DX12
Efficacy
Vasodilator (coronary)
Comment
Active form of prodrug: Linsidomine [DR:D07161]
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01D VASODILATORS USED IN CARDIAC DISEASES
    C01DX Other vasodilators used in cardiac diseases
     C01DX12 Molsidomine
      D01320  Molsidomine (JAN/USAN/INN)
Other DBs
CAS: 25717-80-0
PubChem: 7848383
ChEBI: 31861
LigandBox: D01320
NIKKAJI: J152.075J
KCF data

ATOM        17
            1   N1y N    28.2886  -17.5082
            2   C1x C    27.5817  -18.7170
            3   C1x C    28.2750  -19.9334
            4   O2x O    29.6754  -19.9412
            5   C1x C    30.3821  -18.7324
            6   C1x C    29.6888  -17.5159
            7   N5y N    27.5954  -16.2921 #+
            8   N5x N    28.0311  -14.9619
            9   O2x O    26.8956  -14.1360
            10  C8y C    25.7603  -14.9619
            11  C8x C    26.1958  -16.2921
            12  N1b N    24.5488  -14.2563 #-
            13  C7a C    23.3400  -14.9561
            14  O7a O    22.1312  -14.2563
            15  C1b C    20.9224  -14.9561
            16  O6a O    23.3400  -16.3558
            17  C1a C    19.7095  -14.2576
BOND        18
            1     3   4 1
            2     4   5 1
            3     7   8 2
            4     8   9 1
            5     9  10 1
            6    10  11 2
            7    11   7 1
            8     5   6 1
            9    10  12 1
            10    6   1 1
            11   12  13 1
            12   13  14 1
            13    1   7 1
            14   14  15 1
            15    1   2 1
            16   13  16 2
            17    2   3 1
            18   15  17 1

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Ontology (1)   
   KEGG BRITE (1)   
Drug (1)   
   LigandBox (1)   
Chemical substance (8)   
   PubChem (1)   
   ChEBI (1)   
   MASSBANK (5)   
   NIKKAJI (1)   
All databases (10)   

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