KEGG   DRUG: Doxercalciferol
Entry
D01009                      Drug                                   
Name
Doxercalciferol (USAN/INN);
Hectorol (TN)
Product
HECTOROL (Genzyme Corporation)
  Generic
DOXERCALCIFEROL (Alembic Pharmaceuticals), DOXERCALCIFEROL (Amneal Pharmaceuticals LLC), DOXERCALCIFEROL (Amneal Pharmaceuticals LLC), DOXERCALCIFEROL (Chartwell RX), DOXERCALCIFEROL (Dr.Reddy's Laboratories), DOXERCALCIFEROL (Eugia US LLC), DOXERCALCIFEROL (Heritage Pharmaceuticals Inc. d/b/a Avet Pharmaceuticals), DOXERCALCIFEROL (Hikma Pharmaceuticals USA), DOXERCALCIFEROL (Lupin Pharmaceuticals), DOXERCALCIFEROL (Meitheal Pharmaceuticals)
Formula
C28H44O2
Exact mass
412.3341
Mol weight
412.6478
Structure
Simcomp
Class
Gastrointestinal agent
 DG01607  Vitamin D derivatives
Remark
Same as: C08211
ATC code: H05BX03
Product: D01009<US>
Efficacy
Antihyperparathyroidism
  Disease
Secondary hyperparathyroidism [DS:H01669]
Comment
a pro-hormone vitamin D2 [CPD:C05441] analog
Target
NR1I1 (VDR) [HSA:7421] [KO:K08539]
  Pathway
hsa04928  Parathyroid hormone synthesis, secretion and action
hsa04961  Endocrine and other factor-regulated calcium reabsorption
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H05 CALCIUM HOMEOSTASIS
   H05B ANTI-PARATHYROID AGENTS
    H05BX Other anti-parathyroid agents
     H05BX03 Doxercalciferol
      D01009  Doxercalciferol (USAN/INN) <US>
USP drug classification [BR:br08302]
 Metabolic Bone Disease Agents
  Vitamin D-related Agents
   Doxercalciferol
    D01009  Doxercalciferol (USAN/INN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01607  Vitamin D derivatives
   D01009  Doxercalciferol
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Vitamin D3 like receptor
    NR1I1 (VDR)
     D01009  Doxercalciferol (USAN/INN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D01009
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D01009
Other DBs
CAS: 54573-75-0
PubChem: 7848072
ChEBI: 4712
PDB-CCD: V2H[PDBj]
LigandBox: D01009
KCF data

ATOM        30
            1   C1x C    15.0500  -21.4900
            2   C1x C    15.0500  -22.8900
            3   C2y C    16.2624  -23.5900
            4   C1y C    17.4749  -22.8900
            5   C1z C    17.4749  -21.4900
            6   C1x C    16.2624  -20.7900
            7   C1x C    18.8064  -23.3226
            8   C1x C    19.6293  -22.1900
            9   C1y C    18.8064  -21.0574
            10  C1a C    17.4749  -20.0900
            11  C2b C    16.2624  -24.9898
            12  C2b C    15.0332  -25.6997
            13  C2y C    15.0334  -27.0899
            14  C1x C    13.8335  -27.7830
            15  C1y C    13.8338  -29.1830
            16  C1x C    15.0464  -29.8827
            17  C1y C    16.2463  -29.1896
            18  C2y C    16.2460  -27.7896
            19  C2a C    17.4536  -27.0921
            20  O1a O    17.4543  -29.8868
            21  O1a O    12.6384  -29.8738
            22  C1c C    19.2375  -19.7306
            23  C2b C    20.6375  -19.7306
            24  C1a C    18.4235  -18.6100
            25  C2b C    21.3366  -18.5199
            26  C1c C    22.7497  -18.5197
            27  C1a C    23.4633  -19.7547
            28  C1c C    23.4365  -17.3299
            29  C1a C    24.8497  -17.3295
            30  C1a C    22.7527  -16.1460
BOND        32
            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    5   9 1
            11    5  10 1 #Up
            12    3  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   13  18 1
            21   18  19 2
            22   17  20 1 #Up
            23   15  21 1 #Down
            24    9  22 1
            25   22  23 1
            26   22  24 1 #Down
            27   23  25 2
            28   25  26 1
            29   26  27 1 #Up
            30   26  28 1
            31   28  29 1
            32   28  30 1

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Ontology (6)   
   KEGG BRITE (6)   
Disease (1)   
   KEGG DISEASE (1)   
Drug (3)   
   KEGG DGROUP (1)   
   LigandBox (1)   
   SIDER (1)   
Chemical substance (4)   
   KEGG COMPOUND (1)   
   PubChem (1)   
   ChEBI (1)   
   PDB-CCD (1)   
Gene (2)   
   KEGG ORTHOLOGY (1)   
   KEGG GENES (1)   
All databases (16)   

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