KEGG   DRUG: Tacalcitol hydrateHelp
Entry
D01472                      Drug                                   

Name
Tacalcitol hydrate (JP17);
Bonalfa high (TN);
Curatoderm (TN)
Formula
C27H44O3. H2O
Exact mass
434.3396
Mol weight
434.6517
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01607  Vitamin D derivatives
  DG01606  Activated vitamin D3
Remark
Therapeutic category: 2691
ATC code: D05AX04
Chemical structure group: DG00395
Product (DG00395): D01472<JP>
Efficacy
Antipsoriatic, Vitamin D receptor agonist
Comment
vitamin D3 analogue
Target
NR1I1 (VDR) [HSA:7421] [KO:K08539]
  Pathway
hsa04961  Endocrine and other factor-regulated calcium reabsorption
hsa04978  Mineral absorption
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D05 ANTIPSORIATICS
   D05A ANTIPSORIATICS FOR TOPICAL USE
    D05AX Other antipsoriatics for topical use
     D05AX04 Tacalcitol
      D01472  Tacalcitol hydrate (JP17) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  26  Epidermides
   269  Miscellaneous
    2691  Vitamins for external use
     D01472  Tacalcitol hydrate (JP17)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Vitamin D3 like receptor
    NR1I1 (VDR)
     D01472  Tacalcitol hydrate (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01472  Tacalcitol hydrate
  D01472  Tacalcitol lotion
  D01472  Tacalcitol oinment
BRITE hierarchy
Other DBs
CAS: 93129-94-3
PubChem: 7848535
LigandBox: D01472
LinkDB All DBs
KCF data Show

ATOM        31
            1   C1x C    21.9974  -17.9475
            2   C1x C    21.9974  -19.3493
            3   C2y C    23.2114  -20.0502
            4   C1y C    24.4254  -19.3493
            5   C1z C    24.4254  -17.9475
            6   C1x C    23.2114  -17.2467
            7   C1x C    25.7586  -19.7825
            8   C1x C    26.5826  -18.6484
            9   C1y C    25.7586  -17.5144
            10  C1a C    24.4254  -16.5458
            11  C2b C    23.2114  -21.4518
            12  C2b C    21.9806  -22.1626
            13  C2y C    21.9806  -23.5644
            14  C1x C    20.7835  -24.2556
            15  C1y C    20.7835  -25.6574
            16  C1x C    21.9974  -26.3583
            17  C1y C    23.1945  -25.6671
            18  C2y C    23.1945  -24.2653
            19  C2a C    24.4085  -23.5644
            20  O1a O    24.4002  -26.3631
            21  O1a O    19.5864  -26.3487
            22  C1c C    26.1903  -16.1859
            23  C1b C    27.5921  -16.1859
            24  C1b C    28.2921  -14.9736
            25  C1a C    25.3752  -15.0639
            26  C1c C    29.7070  -14.9734
            27  O1a O    30.4215  -16.2100
            28  C1c C    30.3947  -13.7821
            29  C1a C    31.7800  -13.7821
            30  C1a C    29.6944  -12.5694
            31  O0  O    30.5484  -22.9239
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   23  24 1
            27   22  25 1 #Down
            28   24  26 1
            29   26  27 1 #Down
            30   26  28 1
            31   28  29 1
            32   28  30 1

» Japanese version   » Back

DBGET integrated database retrieval system