KEGG   DRUG: Retinol palmitate
Entry
D00164                      Drug                                   

Name
Retinol palmitate (JP18);
Aquasol A (TN)
Product
Formula
C36H60O2
Exact mass
524.4593
Mol weight
524.8604
Structure
Simcomp
Class
Other
 DG01604  Retinol derivative
Metabolizing enzyme substrate
 DG02918  CYP2C8 substrate
Remark
Same as: C02588
Therapeutic category: 3111
ATC code: A11CA01 D10AD02 R01AX02 S01XA02
Chemical structure group: DG00123
Product (DG00123): D06543<JP> D00164<JP/US>
Product (mixture): D08830<JP>
Efficacy
Supplement (vitamin A), Retinoic acid receptor (RAR) agonist
Target
NR1B (RAR) [HSA:5914 5915 5916] [KO:K08527 K08528 K08529]
Metabolism
Enzyme: CYP2C8 [HSA:1558]
Interaction
Structure map
map07223  Retinoic acid receptor (RAR) and retinoid X receptor (RXR) agonists/antagonists
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
    A11CA Vitamin A, plain
     A11CA01 Retinol (vit A)
      D00164  Retinol palmitate (JP18) <JP/US>
 D DERMATOLOGICALS
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AD Retinoids for topical use in acne
     D10AD02 Retinol
      D00164  Retinol palmitate (JP18) <JP/US>
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AX Other nasal preparations
     R01AX02 Retinol
      D00164  Retinol palmitate (JP18) <JP/US>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01X OTHER OPHTHALMOLOGICALS
    S01XA Other ophthalmologicals
     S01XA02 Retinol
      D00164  Retinol palmitate (JP18) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   311  Vitamins A and D preparations
    3111  Synthetic vitamin A preparations
     D00164  Retinol palmitate (JP18)
Classification of Japanese OTC drugs [BR:br08313]
 Nourishing tonics and health supplements
  32 Vitamin A based drugs
   D00164  Retinol palmitate (JP18)
  43 Vitamin containing supplements
   D00164  Retinol palmitate (JP18)
 Agents for ophthalmologic use
  62 General eye drops
   D00164  Retinol palmitate (JP18)
Risk category of Japanese OTC drugs [BR:br08312]
 Designated second-class OTC drugs
  Inorganic and organic chemicals
   Retinol palmitate
    D00164  Retinol palmitate (JP18)
 Second-class OTC drugs
  Inorganic and organic chemicals
   Retinol palmitate
    D00164  Retinol palmitate (JP18)
 Third-class OTC drugs
  Inorganic and organic chemicals
   Retinol palmitate
    D00164  Retinol palmitate (JP18)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Retinoic acid receptor (RAR)
    NR1B (RAR)
     D00164  Retinol palmitate (JP18) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00164  Retinol palmitate
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00164
Other DBs
CAS: 79-81-2
PubChem: 7847232
ChEBI: 17616
ChEMBL: CHEMBL1675
LigandBox: D00164
NIKKAJI: J3.849K
KCF data

ATOM        38
            1   C2y C    14.6300  -21.4900
            2   C2b C    15.8200  -20.7900
            3   C2b C    17.0100  -21.4900
            4   C2c C    18.2000  -20.7900
            5   C2b C    19.3900  -21.4900
            6   C1a C    18.2000  -19.4600
            7   C2b C    20.5800  -20.7900
            8   C2b C    21.8400  -21.4900
            9   C2c C    23.0300  -20.7900
            10  C2b C    24.2200  -21.4900
            11  C1a C    23.0300  -19.3900
            12  C1b C    25.4100  -20.7900
            13  O7a O    26.6000  -21.4900
            14  C7a C    27.7900  -20.7900
            15  C1b C    29.0500  -21.4900
            16  O6a O    27.7900  -19.3900
            17  C1b C    30.2400  -20.7900
            18  C1b C    31.4300  -21.4900
            19  C1b C    32.6200  -20.7900
            20  C1b C    33.8100  -21.4900
            21  C1b C    35.0000  -20.7900
            22  C1b C    36.1900  -21.4900
            23  C1b C    36.1900  -22.8900
            24  C1b C    35.0000  -23.5900
            25  C1b C    33.8100  -22.8900
            26  C1b C    32.6200  -23.5200
            27  C1b C    31.4300  -22.8900
            28  C1b C    30.1700  -23.5200
            29  C1b C    28.9800  -22.8200
            30  C1a C    27.7900  -23.5200
            31  C1z C    13.4119  -20.7999
            32  C1x C    12.2752  -21.5097
            33  C1x C    12.2166  -22.9097
            34  C1x C    13.4347  -23.5998
            35  C2y C    14.6414  -22.8900
            36  C1a C    12.5142  -19.7422
            37  C1a C    14.2389  -19.6404
            38  C1a C    15.8508  -23.5752
BOND        38
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     4   6 1
            6     5   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    9  11 1
            11   10  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   14  16 2
            16   15  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30    1  31 1
            31   31  32 1
            32   32  33 1
            33   33  34 1
            34   34  35 1
            35    1  35 2
            36   31  36 1
            37   31  37 1
            38   35  38 1

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