KEGG   DRUG: Berberine chloride hydrateHelp
Entry
D01250                      Drug                                   

Name
Berberine chloride hydrate (JP17);
Kyoberin (TN)
Formula
C20H18NO4. Cl. xH2O
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-allergic agent
 DG01957  Antidiarrheal
Remark
Therapeutic category: 2314
Chemical structure group: DG01773
Product (DG01773): D01250<JP> D03293<JP>
Product (mixture): D04362<JP>
Efficacy
Antidiarrheal
Metabolism
Transporter: ABCB1 [HSA:5243]
Interaction
Drug interaction
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  23  Digestive organ agents
   231  Antidiarrheals, intestinal regulators
    2314  Berberines
     D01250  Berberine chloride hydrate (JP17)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for digestive organs
  16 Antidiarrheals
   D01250  Berberine chloride hydrate (JP17)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Berberine
    D01250  Berberine chloride hydrate (JP17)
 Third-class OTC drugs
  Inorganic and organic chemicals
   Coptis rhizome
    D01250  Berberine chloride hydrate (JP17)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01250  Berberine chloride hydrate
BRITE hierarchy
Other DBs
PubChem: 7848313
LigandBox: D01250
KCF data Show

ATOM        27
            1   C8y C    23.5948  -15.4046
            2   C8y C    23.5948  -16.8055
            3   C8x C    24.8079  -17.5059
            4   C8y C    26.0211  -16.8055
            5   C8y C    26.0211  -15.4046
            6   C8x C    24.8079  -14.7042
            7   C8y C    27.2343  -17.5059
            8   N5y N    28.4474  -16.8055 #+
            9   C1x C    28.4474  -15.4046
            10  C1x C    27.2343  -14.7042
            11  C8x C    27.2343  -18.9068
            12  C8y C    28.4474  -19.6072
            13  C8y C    29.6607  -18.9068
            14  C8x C    29.6607  -17.5059
            15  C8x C    28.4474  -21.0081
            16  C8x C    29.6607  -21.7085
            17  C8y C    30.8738  -21.0081
            18  C8y C    30.8738  -19.6072
            19  O2x O    22.2624  -14.9718
            20  C1x C    21.4390  -16.1051
            21  O2x O    22.2624  -17.2384
            22  O2a O    32.0911  -18.9045
            23  C1a C    33.2893  -19.5964
            24  O2a O    32.0911  -21.7108
            25  C1a C    33.2893  -21.0189
            26  X   Cl   30.7393  -16.7354 #-
            27  O0  O    34.7900  -16.7300
BOND        29
            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 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    7  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    8  14 2
            17   12  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21   13  18 1
            22    1  19 1
            23   19  20 1
            24   20  21 1
            25    2  21 1
            26   18  22 1
            27   22  23 1
            28   17  24 1
            29   24  25 1
BRACKET     1    32.7600  -17.6400   32.7600  -15.6800
            1    35.3500  -15.6800   35.3500  -17.6400
            1  x
 ORIGINAL  1   27
 REPEAT    1

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