KEGG   DRUG: CortivazolHelp
Entry
D03594                      Drug                                   

Name
Cortivazol (USAN)
Formula
C32H38N2O5
Exact mass
530.2781
Mol weight
530.6545
Structure
Mol fileKCF fileDB search
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: H02AB17
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H02 CORTICOSTEROIDS FOR SYSTEMIC USE
   H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
    H02AB Glucocorticoids
     H02AB17 Cortivazol
      D03594  Cortivazol (USAN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D03594  Cortivazol (USAN)
BRITE hierarchy
Other DBs
CAS: 1110-40-3
PubChem: 17397706
ChEMBL: CHEMBL2105842
LigandBox: D03594
NIKKAJI: J34.127D
LinkDB All DBs
KCF data Show

ATOM        39
            1   C8y C    23.9400  -14.8400
            2   C8y C    23.9400  -16.2400
            3   C2x C    25.1300  -16.9400
            4   C2y C    26.3200  -16.2400
            5   C1z C    26.3200  -14.8400
            6   C1x C    25.1300  -14.2100
            7   C2y C    27.5100  -16.9400
            8   C2x C    28.7000  -16.2400
            9   C1y C    28.7000  -14.8400
            10  C1y C    27.5100  -14.2100
            11  C1y C    29.8200  -14.2100
            12  C1z C    29.8200  -12.8100
            13  C1x C    28.7000  -12.1800
            14  C1y C    27.5100  -12.8100
            15  C1x C    32.2000  -14.2100
            16  C1y C    32.2000  -12.8100
            17  C1z C    31.0100  -12.1800
            18  C1a C    26.3200  -13.5100
            19  C1a C    29.8200  -11.4800
            20  C5a C    31.0100  -10.4300
            21  O1a O    26.3200  -12.1800
            22  C1b C    32.2000   -9.7300
            23  O5a O    29.8200   -9.7300
            24  O1a O    32.2000  -11.4800
            25  O7a O    33.3900  -10.4300
            26  C7a C    34.5100   -9.8000
            27  C1a C    35.7000  -10.4300
            28  O6a O    34.5100   -8.4000
            29  C1a C    33.6000  -12.8100
            30  C1a C    27.5100  -18.3400
            31  C8x C    22.7500  -14.1400
            32  N5x N    21.4900  -14.8400
            33  N4y N    21.4900  -16.2400
            34  C8y C    20.5100  -17.2200
            35  C8x C    19.1800  -16.8700
            36  C8x C    18.1300  -17.8500
            37  C8x C    18.5500  -19.2500
            38  C8x C    19.8800  -19.6000
            39  C8x C    20.8600  -18.6200
BOND        44
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 2
            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    5  18 1 #Up
            22   12  19 1 #Up
            23   17  20 1 #Up
            24   14  21 1 #Up
            25   20  22 1
            26   20  23 2
            27   17  24 1 #Down
            28   22  25 1
            29   25  26 1
            30   26  27 1
            31   26  28 2
            32   16  29 1 #Down
            33    7  30 1
            34    1  31 1
            35   31  32 2
            36   32  33 1
            37    2  33 1
            38   33  34 1
            39   34  35 2
            40   35  36 1
            41   36  37 2
            42   37  38 1
            43   38  39 2
            44   34  39 1

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