KEGG   DRUG: Prednicarbate
Entry
D05601                      Drug                                   

Name
Prednicarbate (USP/INN);
Dermatop (TN)
Product
  Generic
Formula
C27H36O8
Exact mass
488.241
Mol weight
488.5699
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: D07AC18
Product: D05601<US>
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AC Corticosteroids, potent (group III)
     D07AC18 Prednicarbate
      D05601  Prednicarbate (USP/INN) <US>
USP drug classification [BR:br08302]
 Dermatological Agents
  Dermatitis and Pruitus Agents
   Glucocorticoids, Medium Potency
    Prednicarbate
     D05601  Prednicarbate (USP/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D05601  Prednicarbate (USP/INN) <US>
Other DBs
CAS: 73771-04-7
PubChem: 47207264
ChEMBL: CHEMBL1200386
DrugBank: DB01130
LigandBox: D05601
NIKKAJI: J12.640C
LinkDB
KCF data

ATOM        35
            1   C2x C     6.5451   -9.4485
            2   C5x C     6.5451  -10.8154
            3   C2x C     7.7290  -11.4990
            4   C2y C     8.9128  -10.8154
            5   C1z C     8.9128   -9.4485
            6   C2x C     7.7290   -8.7650
            7   C1x C    10.0967  -11.4990
            8   C1x C    11.2804  -10.8154
            9   C1y C    11.2804   -9.4485
            10  C1y C    10.0967   -8.7650
            11  C1y C    12.4643   -8.7650
            12  C1z C    12.4643   -7.3980
            13  C1x C    11.2804   -6.7145
            14  C1y C    10.0967   -7.3980
            15  C1x C    14.8319   -8.7650
            16  C1x C    14.8319   -7.3980
            17  C1z C    13.6481   -6.7145
            18  C5a C    13.6481   -4.9324
            19  O7a O    14.8319   -6.0311
            20  C7a C    16.0188   -6.6993
            21  O6a O    16.0486   -8.0576
            22  O7a O    17.1802   -5.9943
            23  C1b C    18.3787   -6.6517
            24  C1a C    19.5311   -5.9522
            25  C1a C    12.4643   -6.1678
            26  O1a O     8.9148   -6.7157
            27  C1a C     8.9128   -8.0815
            28  O5x O     5.3613  -11.4990
            29  C1b C    14.8445   -4.2416
            30  O5a O    12.4177   -4.2226
            31  O7a O    16.0539   -4.9401
            32  C7a C    17.2401   -4.2557
            33  C1b C    18.4455   -4.9521
            34  O6a O    17.2405   -2.8929
            35  C1a C    19.6757   -4.2418
BOND        38
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 2
            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 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21   17  18 1 #Up
            22   17  19 1 #Down
            23   19  20 1
            24   20  21 2
            25   20  22 1
            26   22  23 1
            27   23  24 1
            28   12  25 1 #Up
            29   14  26 1 #Up
            30    5  27 1 #Up
            31    2  28 2
            32   18  29 1
            33   18  30 2
            34   29  31 1
            35   31  32 1
            36   32  33 1
            37   32  34 2
            38   33  35 1

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