KEGG DRUG: Calcitriol

DRUG: Calcitriol

Entry

D00129                      Drug

Name

Calcitriol (JAN/USP/INN);
Rocaltrol (TN)

Product

ROCALTROL (Validus Pharmaceuticals LLC), VECTICAL (Galderma Laboratories)

Generic

CALCITRIOL (A-S Medication Solutions), CALCITRIOL (American Health Packaging), CALCITRIOL (Amneal Pharmaceuticals LLC), CALCITRIOL (Aphena Pharma Solutions - Tennessee), CALCITRIOL (Aphena Pharma Solutions - Tennessee), CALCITRIOL (Aphena Pharma Solutions - Tennessee), CALCITRIOL (Aphena Pharma Solutions - Tennessee), CALCITRIOL (Avet Pharmaceuticals), CALCITRIOL (BIONPHARMA), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Bryant Ranch Prepack), CALCITRIOL (Cardinal Health 107), CALCITRIOL (Chartwell RX), CALCITRIOL (FOSUN PHARMA USA), CALCITRIOL (Gland Pharma Limited), CALCITRIOL (Golden State Medical Supply), CALCITRIOL (Hikma Pharmaceuticals USA), CALCITRIOL (Hikma Pharmaceuticals USA), CALCITRIOL (PD-Rx Pharmaceuticals), CALCITRIOL (Padagis Israel Pharmaceuticals), CALCITRIOL (Patrin Pharma), CALCITRIOL (Rising Pharmaceuticals), CALCITRIOL (Strides Pharma Science Limited), CALCITRIOL (Sun Pharmaceutical Industries), CALCITRIOL (Sun Pharmaceutical Industries), CALCITRIOL (Teva Pharmaceuticals USA), CALCITROL (Mayne Pharma Commercial LLC.)

Formula

C27H44O3

Exact mass

416.329

Mol weight

416.6365

Structure

Simcomp

Class

Gastrointestinal agent
DG01607  Vitamin D derivatives
  DG01606  Activated vitamin D3
Musculo-skeletal system agent
DG03232  Osteoporosis agent

Remark

Same as:

C01673

Therapeutic category:

3112

ATC code:

A11CC04 D05AX03

Product:

D00129<JP/US>

Efficacy

Osteoporosis agent, Vitamin D receptor agonist

Disease

Hypoparathyroidism [DS:H01862]
Plaque psoriasis [DS:H01656]

Comment

Vitamine D3 analogue

Target

NR1I1 (VDR) [HSA:7421] [KO:K08539]

Pathway

hsa04961

Endocrine and other factor-regulated calcium reabsorption

hsa04978

Mineral absorption

Interaction

Structure map

map07047

Osteoporosis drugs

Brite

Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
  A11 VITAMINS
   A11C VITAMIN A AND D, INCL. COMBINATIONS OF THE TWO
    A11CC Vitamin D and analogues
     A11CC04 Calcitriol
      D00129  Calcitriol (JAN/USP/INN) <JP/US>
D DERMATOLOGICALS
  D05 ANTIPSORIATICS
   D05A ANTIPSORIATICS FOR TOPICAL USE
    D05AX Other antipsoriatics for topical use
     D05AX03 Calcitriol
      D00129  Calcitriol (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
Dermatological Agents
  Dermatological Agents, Other
   Psoriasis Agents
    Calcitriol
     D00129  Calcitriol (JAN/USP/INN)
Metabolic Bone Disease Agents
  Vitamin D-related Agents
   Calcitriol
    D00129  Calcitriol (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
3  Agents affecting metabolism
  31  Vitamins
   311  Vitamins A and D preparations
    3112  Synthetic vitamin D preparations
     D00129  Calcitriol (JAN/USP/INN)
Drug groups [BR:br08330]
Gastrointestinal agent
  DG01607  Vitamin D derivatives
   DG01606  Activated vitamin D3
    D00129  Calcitriol
Musculo-skeletal system agent
  DG03232  Osteoporosis agent
   D00129  Calcitriol
Drug classes [BR:br08332]
Musculo-skeletal system agent
  DG03232  Osteoporosis agent
   D00129  Calcitriol
Target-based classification of drugs [BR:br08310]
Nuclear receptors
  Thyroid hormone like receptors
   Vitamin D3 like receptor
    NR1I1 (VDR)
     D00129  Calcitriol (JAN/USP/INN) <JP/US>
Prodrugs [br08324.html]
D00129

Other DBs

CAS:	32222-06-3

PubChem:

7847197

ChEBI:

17823

PDB-CCD:

VDX[PDBj]

LigandBox:

D00129

NIKKAJI:

J17.427K

KCF data

ATOM        30
            1   C1x C    21.2800  -22.4000
            2   C1x C    21.2800  -23.8000
            3   C2y C    22.4924  -24.5000
            4   C1y C    23.7049  -23.8000
            5   C1z C    23.7049  -22.4000
            6   C1x C    22.4924  -21.7000
            7   C1x C    25.0364  -24.2326
            8   C1x C    25.8593  -23.1000
            9   C1y C    25.0364  -21.9674
            10  C1a C    23.7049  -21.0000
            11  C2b C    22.4924  -25.8998
            12  C2b C    21.2632  -26.6097
            13  C2y C    21.2632  -28.0097
            14  C1x C    20.0676  -28.7000
            15  C1y C    20.0676  -30.1000
            16  C1x C    21.2800  -30.8000
            17  C1y C    22.4756  -30.1097
            18  C2y C    22.4756  -28.7097
            19  C2a C    23.6880  -28.0097
            20  O1a O    23.6797  -30.8048
            21  O1a O    18.8721  -30.7904
            22  C1c C    25.4675  -20.6406
            23  C1b C    26.8675  -20.6406
            24  C1a C    24.6535  -19.5200
            25  C1b C    27.5666  -19.4299
            26  C1b C    28.9797  -19.4297
            27  C1d C    29.6665  -18.2399
            28  O1a O    31.0797  -18.2395
            29  C1a C    28.9827  -17.0560
            30  C1a C    30.3832  -19.4806
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 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   27  29 1
            32   27  30 1

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