KEGG   DRUG: D02347Help
Entry
D02347                      Drug                                   

Name
Dantrolene (USAN/INN)
Formula
C14H10N4O5
Exact mass
314.0651
Mol weight
314.253
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Relaxant [skeletal muscle]
Remark
Same as: 
ATC code: 
Drug group: 
Target
ryanodine receptor antagonist [HSA:6261 6262 6263] [KO:K04961 K04962 K04963]
  Pathway
hsa04020  Calcium signaling pathway  
 
Metabolism
Enzyme: CYP1A2 [HSA:1544]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M03 MUSCLE RELAXANTS
   M03C MUSCLE RELAXANTS, DIRECTLY ACTING AGENTS
    M03CA Dantrolene and derivatives
     M03CA01 Dantrolene
      D02347  Dantrolene (USAN/INN)
USP drug classification [BR:br08302]
 Antispasticity Agents
  Dantrolene
   D02347  Dantrolene (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ryanodine and IP3 receptors
   Ryanodine receptor (RYR)
    ryanodine receptor (RYR1)
     Dantrolene
      D02347  Dantrolene (USAN/INN)
    ryanodine receptor (RYR2)
     Dantrolene
      D02347  Dantrolene (USAN/INN)
    ryanodine receptor (RYR3)
     Dantrolene
      D02347  Dantrolene (USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP1A2
   Dantrolene
    D02347  Dantrolene (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
7261-97-4
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   C8y C    15.5572  -14.7001
            2   C8y C    14.3407  -14.0007
            3   O2x O    16.6972  -13.8713
            4   C8x C    15.9920  -16.0399
            5   C8x C    13.1243  -14.7001
            6   C8x C    14.3407  -12.5904
            7   C8y C    17.8373  -14.7001
            8   C8x C    17.4023  -16.0399
            9   C8x C    11.9079  -14.0007
            10  C8x C    13.1243  -11.8911
            11  C2b C    19.0535  -14.0007
            12  C8y C    11.9079  -12.5904
            13  N2b N    20.2759  -14.7001
            14  N2b N    10.6857  -11.8911 #+
            15  N1y N    21.6330  -14.0007
            16  O3a O     9.4224  -12.6842
            17  O3a O    10.6915  -10.4808 #-
            18  C1x C    22.7850  -14.5648
            19  C5x C    21.6450  -12.5904
            20  C5x C    23.7252  -13.5190
            21  N1x N    23.0669  -12.3025
            22  O5x O    20.6049  -11.9315
            23  O5x O    25.0300  -13.5251
BOND        25
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     6  10 2
            10    7  11 1
            11    9  12 2
            12   11  13 2
            13   12  14 1
            14   13  15 1
            15   14  16 2
            16   14  17 1
            17   15  18 1
            18   15  19 1
            19   18  20 1
            20   19  21 1
            21   19  22 2
            22   20  23 2
            23    7   8 2
            24   10  12 1
            25   20  21 1

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