KEGG   COMPOUND: C06527Help
Entry
C06527                      Compound                               

Name
Quinidine;
(+)-Quinidine
Formula
C20H24N2O2
Exact mass
324.1838
Mol weight
324.4168
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Biosynthesis of alkaloids derived from shikimate pathway
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Quinoline alkaloids
    C06527  Quinidine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01B ANTIARRHYTHMICS, CLASS I AND III
    C01BA Antiarrhythmics, class Ia
     C01BA01 Quinidine
      D08458  Quinidine (BAN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Antiarrhythmics
   Quinidine
    D08458  Quinidine (BAN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated cation channels
   Na+ channel, SCN alpha, NaV1.x
    voltage-gated sodium channel (SCN1A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN2A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN3A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN4A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN5A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN8A)
     Quinidine
      D08458  Quinidine (BAN)
    voltage-gated sodium channel (SCN9A)
     Quinidine
      D08458  Quinidine (BAN)
Cytochrome P450 interactions [BR:br08309]
 CYP inhbitors
  CYP2D6
   Quinidine
    D08458  Quinidine (BAN)
 CYP substrates
  CYP3A4
   Quinidine
    D08458  Quinidine (BAN)
  CYP3A
   Quinidine
    D08458  Quinidine (BAN)
 Transporter inhibitors
  ABCB1
   Quinidine
    D08458  Quinidine (BAN)
  SLC22A1
   Quinidine
    D08458  Quinidine (BAN)
  SLC22A2
   Quinidine
    D08458  Quinidine (BAN)
  MATE1
   Quinidine
    D08458  Quinidine (BAN)
  MATE2
   Quinidine
    D08458  Quinidine (BAN)
 Transporter substrates
  ABCB1
   Quinidine
    D08458  Quinidine (BAN)
  SLC22A1
   Quinidine
    D08458  Quinidine (BAN)
  SLC22A3
   Quinidine
    D08458  Quinidine (BAN)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from tryptophan and anthranillic acid
   Quinoline alkaloids
    D08458  Quinidine (BAN)
BRITE hierarchy
Other DBs
CAS: 
56-54-2
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C8y C    25.2112  -26.7860
            2   C8y C    26.4311  -26.0881
            3   C8y C    25.2052  -28.1880
            4   C8x C    24.0030  -26.0822
            5   C1c C    26.4370  -24.6862
            6   C8x C    27.6452  -26.7978
            7   C8x C    24.0030  -28.8916
            8   N5x N    26.4194  -28.8976
            9   C8y C    22.7829  -26.7860
            10  C1y C    27.6570  -23.9883
            11  O1a O    25.2229  -23.9766
            12  C8x C    27.6394  -28.1995
            13  C8x C    22.7829  -28.1880
            14  O2a O    21.5688  -26.0822
            15  N1y N    29.0942  -23.1144
            16  C1x C    26.9239  -22.9443
            17  C1a C    21.5688  -24.6804
            18  C1x C    29.0942  -21.8710
            19  C1x C    30.5956  -23.9179
            20  C1y C    28.3373  -22.1055
            21  C1y C    28.3433  -21.1202
            22  C1x C    29.8977  -22.8094
            23  C2b C    27.8095  -19.8181
            24  C2a C    28.6718  -18.7094
BOND        27
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    5  11 1 #Down
            11    6  12 1
            12    7  13 2
            13    9  14 1
            14   10  15 1
            15   10  16 1
            16   14  17 1
            17   15  18 1
            18   15  19 1
            19   16  20 1
            20   18  21 1
            21   19  22 1
            22   21  23 1 #Up
            23   23  24 2
            24    8  12 2
            25    9  13 1
            26   20  21 1
            27   20  22 1

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