KEGG DRUG: Vitamin A

DRUG: Vitamin A

Entry

D06543                      Drug

Name

Vitamin A (USP);
Retinol;
Vitamin A1;
Aquasol A (TN)

Formula

C20H30O

Exact mass

286.2297

Mol weight

286.4516

Structure

Simcomp

Class

Vitamin and mineral
DG01604 Retinol derivative
Metabolizing enzyme substrate
DG02918 CYP2C8 substrate

Remark

Same as:

C00473

Therapeutic category:

3111

ATC code:

A11CA01 D10AD02 R01AX02 S01XA02

Chemical structure group:

DG00123

Product (DG00123):

D06543<JP> D00164<JP/US>

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)
      D06543  Vitamin A (USP) <JP>
D DERMATOLOGICALS
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AD Retinoids for topical use in acne
     D10AD02 Retinol
      D06543  Vitamin A (USP) <JP>
R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AX Other nasal preparations
     R01AX02 Retinol
      D06543  Vitamin A (USP) <JP>
S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01X OTHER OPHTHALMOLOGICALS
    S01XA Other ophthalmologicals
     S01XA02 Retinol
      D06543  Vitamin A (USP) <JP>
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
     D06543  Vitamin A (USP)
Classification of Japanese OTC drugs [BR:br08313]
Nourishing tonics and health supplements
  32 Vitamin A based drugs
   D06543  Vitamin A (USP)
  39 Vitamin AD based drugs
   D06543  Vitamin A (USP)
  43 Vitamin containing supplements
   D06543  Vitamin A (USP)
Risk category of Japanese OTC drugs [BR:br08312]
Designated second-class OTC drugs
  Inorganic and organic chemicals
   Retinol
    D06543  Vitamin A (USP)
Second-class OTC drugs
  Inorganic and organic chemicals
   Vitamin A
    D06543  Vitamin A (USP)
Third-class OTC drugs
  Inorganic and organic chemicals
   Vitamin A
    D06543  Vitamin A (USP)
Drug groups [BR:br08330]
Vitamin and mineral
  DG01604  Retinol derivative
   DG00123  Retinol (vit A)
    D06543  Vitamin A
Metabolizing enzyme substrate
  DG02918  CYP2C8 substrate
   DG00123  Retinol (vit A)
    D06543  Vitamin A
Target-based classification of drugs [BR:br08310]
Nuclear receptors
  Thyroid hormone like receptors
   Retinoic acid receptor (RAR)
    NR1B (RAR)
     D06543  Vitamin A (USP) <JP>
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
  D06543
Drug groups [BR:br08330]
Vitamin and mineral
  DG01604  Retinol derivative
   DG00123  Retinol (vit A)
Metabolizing enzyme substrate
  DG02918  CYP2C8 substrate
   DG00123  Retinol (vit A)

Other DBs

CAS:

68-26-8

PubChem:

47208199

ChEBI:

17336

PDB-CCD:

RTL[PDBj]

LigandBox:

D06543

NIKKAJI:

J1.417F

KCF data

ATOM        21
            1   C1x C    24.8656  -17.1514
            2   C1x C    24.8656  -18.5603
            3   C1x C    26.0857  -19.2647
            4   C2y C    27.3058  -18.5603
            5   C2y C    27.3058  -17.1514
            6   C1z C    26.0857  -16.4470
            7   C1a C    28.5259  -19.2647
            8   C2b C    29.7460  -17.1514
            9   C2b C    28.5259  -16.4470
            10  C2c C    30.9512  -16.4555
            11  C2b C    32.1470  -17.1459
            12  C2b C    33.3454  -16.4539
            13  C1a C    30.9513  -15.0384
            14  C2b C    34.5425  -17.1451
            15  C2c C    35.7401  -16.4535
            16  C2b C    36.9378  -17.1449
            17  C1b C    38.1352  -16.4533
            18  O1a O    39.3329  -17.1449
            19  C1a C    35.7402  -15.0383
            20  C1a C    27.0756  -15.4570
            21  C1a C    25.0957  -15.4570
BOND        21
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     8   9 2
            9     5   9 1
            10    8  10 1
            11   10  11 2
            12   11  12 1
            13   10  13 1
            14   12  14 2
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 1
            19   15  19 1
            20    6  20 1
            21    6  21 1

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