KEGG   DRUG: ChlormadinoneHelp
Entry
D07670                      Drug                                   

Name
Chlormadinone (INN)
Formula
C21H27ClO3
Exact mass
362.1649
Mol weight
362.8903
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01666  Progesterone receptor agonist
 DG02004  Progesterone
Remark
ATC code: G03DB06
Chemical structure group: DG00469
Product (DG00469): D01299<JP>
Efficacy
Menstruation disorder agent, Prostatic hyperplasia treatment, Progesterone receptor agonist, Androgen receptor antagonist
Comment
Progestin, Pregnadien derivative
Target
NR3C3 (PGR) [HSA:5241] [KO:K08556]
NR3C4 (AR) [HSA:367] [KO:K08557]
  Pathway
hsa04114  Oocyte meiosis
hsa04914  Progesterone-mediated oocyte maturation
hsa04915  Estrogen signaling pathway
Interaction
Drug interaction
Structure map
map07225  Glucocorticoid and mineralocorticoid receptor agonists/antagonists
map07226  Progesterone, androgen and estrogen receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
   G03D PROGESTOGENS
    G03DB Pregnadien derivatives
     G03DB06 Chlormadinone
      D07670  Chlormadinone (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C3 (PGR)
     D07670  Chlormadinone (INN)
    NR3C4 (AR)
     D07670  Chlormadinone (INN)
BRITE hierarchy
Other DBs
CAS: 1961-77-9
PubChem: 51091972
ChEMBL: CHEMBL1697830
LigandBox: D07670
NIKKAJI: J13.853C
KCF data Show

ATOM        25
            1   C1z C    22.2255  -14.2313
            2   C1z C    21.0340  -14.8622
            3   C1x C    23.3470  -14.8622
            4   O1a O    23.3470  -13.5304
            5   C5a C    22.2255  -12.8295
            6   C1y C    21.0340  -16.2640
            7   C1x C    19.8424  -14.1612
            8   C1a C    21.0340  -13.5304
            9   C1x C    23.3470  -16.2640
            10  C1a C    21.0339  -12.1285
            11  O5a O    23.4170  -12.1285
            12  C1y C    19.8424  -16.9650
            13  C1x C    18.6508  -14.8622
            14  C1y C    18.6508  -16.2640
            15  C2x C    19.8424  -18.2968
            16  C1z C    17.4592  -16.8949
            17  C2y C    18.6508  -18.9977
            18  C2y C    17.4592  -18.2968
            19  C1x C    16.2676  -16.1939
            20  C1a C    17.4592  -15.5631
            21  X   Cl   18.6507  -20.3295
            22  C2x C    16.2676  -18.9977
            23  C1x C    15.0760  -16.8949
            24  C5x C    15.0760  -18.2968
            25  O5x O    13.8844  -18.9977
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1
            7     2   8 1 #Up
            8     3   9 1
            9     5  10 1
            10    5  11 2
            11    6  12 1
            12    7  13 1
            13   12  14 1
            14   12  15 1
            15   14  16 1
            16   15  17 2
            17   16  18 1
            18   16  19 1
            19   16  20 1 #Up
            20   17  21 1
            21   18  22 2
            22   19  23 1
            23   22  24 1
            24   24  25 2
            25    6   9 1
            26   13  14 1
            27   17  18 1
            28   23  24 1

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