KEGG   COMPOUND: C15493
Entry
C15493                      Compound                               
Name
9-cis-Retinoic acid
Formula
C20H28O2
Exact mass
300.2089
Mol weight
300.4351
Structure
Remark
Same as: D02815
Reaction
R08384 R08385
Pathway
map00830  Retinol metabolism
map01100  Metabolic pathways
map03320  PPAR signaling pathway
map04672  Intestinal immune network for IgA production
map04920  Adipocytokine signaling pathway
map05200  Pathways in cancer
map05222  Small cell lung cancer
map05223  Non-small cell lung cancer
map05226  Gastric cancer
Enzyme
1.2.1.36        1.2.3.1
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0109 Retinoids
    C15493  9-cis-Retinoic acid
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D11 OTHER DERMATOLOGICAL PREPARATIONS
   D11A OTHER DERMATOLOGICAL PREPARATIONS
    D11AH Agents for dermatitis, excluding corticosteroids
     D11AH04 Alitretinoin
      D02815  Alitretinoin (USAN) <US>
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01X OTHER ANTINEOPLASTIC AGENTS
    L01XF Retinoids for cancer treatment
     L01XF02 Alitretinoin
      D02815  Alitretinoin (USAN) <US>
USP drug classification [BR:br08302]
 Antineoplastics
  Retinoids
   Alitretinoin
    D02815  Alitretinoin (USAN)
Drug groups [BR:br08330]
 Vitamin and mineral
  DG01604  Retinol derivative
   D02815  Alitretinoin
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Retinoic acid receptor (RAR)
    NR1B (RAR)
     D02815  Alitretinoin (USAN) <US>
  Hepatocyte nuclear factor 4 like receptors
   Retinoid X receptor (RXR)
    NR2B (RXR)
     D02815  Alitretinoin (USAN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D02815
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D02815
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D02815
Other DBs
CAS: 5300-03-8
PubChem: 17396485
ChEBI: 50648
LIPIDMAPS: LMPR01090022
PDB-CCD: 9CR[PDBj]
NIKKAJI: J528.606I
LinkDB
KCF data

ATOM        22
            1   C2y C    17.3247  -15.7429
            2   C1z C    17.3247  -17.1420
            3   C2y C    16.1099  -15.0496
            4   C2b C    18.5202  -15.0434
            5   C1x C    16.1099  -17.8480
            6   C1a C    17.8603  -18.7470
            7   C1a C    18.6474  -17.4919
            8   C1x C    14.9143  -15.7429
            9   C1a C    16.1035  -13.6632
            10  C2b C    19.7224  -15.7366
            11  C1x C    14.9143  -17.1420
            12  C2c C    20.9178  -15.0369
            13  C2b C    22.1136  -15.7302
            14  C1a C    20.9116  -13.6570
            15  C2b C    22.1138  -17.1500
            16  C2b C    23.3231  -17.8554
            17  C2c C    23.3168  -19.2554
            18  C2b C    24.5261  -19.9608
            19  C6a C    24.5199  -21.3607
            20  O6a O    23.2942  -22.0613
            21  O6a O    25.7097  -22.0547
            22  C1a C    22.0985  -19.9516
BOND        22
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 2
            10    5  11 1
            11   10  12 1
            12   12  13 2
            13   12  14 1
            14    8  11 1
            15   13  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   19  20 1
            21   19  21 2
            22   17  22 1

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