KEGG   DRUG: Glycyrrhetinic acidHelp
Entry
D00156                      Drug                                   

Name
Glycyrrhetinic acid (JAN);
Enoxolone (INN);
Hidermart (TN)
Formula
C30H46O4
Exact mass
470.3396
Mol weight
470.6838
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C02283
Therapeutic category: 2649
ATC code: D03AX10
Product: D00156<JP>
Product (mixture): D08716<JP>
Efficacy
Anti-inflammatory, Antipruritic
Target
HSD11B1 [HSA:3290] [KO:K15680]
  Pathway
hsa00140  Steroid hormone biosynthesis
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D03 PREPARATIONS FOR TREATMENT OF WOUNDS AND ULCERS
   D03A CICATRIZANTS
    D03AX Other cicatrizants
     D03AX10 Enoxolone
      D00156  Glycyrrhetinic acid (JAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  26  Epidermides
   264  Analgesics, anti-itchings, astringents, anti-inflammatory agents
    2649  Others
     D00156  Glycyrrhetinic acid (JAN); Enoxolone (INN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for  urogenital organs and anus
  30 Hemorrhoid drugs for external use
   D00156  Glycyrrhetinic acid (JAN)
 Agents for integumentary system
  57 Analgesic, antipruritic, astringent, and anti-inflammatory remedies (incl. gel patches)
   D00156  Glycyrrhetinic acid (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Glycyrrhetinic acid
    D00156  Glycyrrhetinic acid (JAN)
Pharmaceutical additives in Japan [BR:br08316]
 Skin barrier
  D00156  [004410] Glycyrrhetinic acid
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Dehydrogenases
    HSD11B1
     D00156  Glycyrrhetinic acid (JAN) <JP>
BRITE hierarchy
Other DBs
CAS: 471-53-4
PubChem: 7847224
ChEBI: 30853
ChEMBL: CHEMBL109757 CHEMBL208873 CHEMBL230006
PDB-CCD: CBW[PDBj]
LigandBox: D00156
NIKKAJI: J5.943I
LinkDB All DBs
KCF data Show

ATOM        34
            1   C1x C    25.3365  -16.9949
            2   C1y C    25.3365  -18.3745
            3   C1z C    26.5313  -19.0643
            4   C1y C    27.7261  -18.3745
            5   C1z C    27.7261  -16.9949
            6   C1x C    26.5313  -16.3051
            7   C1x C    28.9208  -19.0643
            8   C1x C    30.1156  -18.3745
            9   C1z C    30.1156  -16.9949
            10  C1y C    28.9208  -16.3051
            11  C1z C    31.3104  -16.3051
            12  C2y C    31.3104  -14.9255
            13  C2x C    30.1156  -14.2357
            14  C5x C    28.9208  -14.9255
            15  C1x C    32.5051  -16.9949
            16  C1x C    33.6999  -16.3051
            17  C1z C    33.6999  -14.9255
            18  C1y C    32.5051  -14.2357
            19  C1x C    34.8947  -14.2357
            20  C1x C    34.8947  -12.8561
            21  C1z C    33.6999  -12.1663
            22  C1x C    32.5051  -12.8561
            23  C6a C    34.8947  -11.4765
            24  O6a O    34.8947  -10.0969
            25  C1a C    32.5051  -11.4765
            26  O1a O    24.1418  -19.0643
            27  C1a C    27.7261  -15.6153
            28  C1a C    31.3104  -17.6847
            29  C1a C    34.8947  -15.6153
            30  C1a C    32.0223  -15.4774
            31  C1a C    25.5558  -20.7296
            32  C1a C    27.5068  -20.7296
            33  O5x O    27.7281  -14.2369
            34  O6a O    36.1118  -12.1795
BOND        38
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            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    9  11 1
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   12  18 1
            22   17  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   18  22 1
            27   21  23 1 #Up
            28   23  24 2
            29   21  25 1 #Down
            30    2  26 1 #Up
            31    5  27 1 #Up
            32    9  28 1 #Up
            33   17  29 1 #Up
            34   11  30 1 #Down
            35    3  31 1
            36    3  32 1
            37   14  33 2
            38   23  34 1

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