KEGG   DRUG: MotretinideHelp
Entry
D05082                      Drug                                   

Name
Motretinide (USAN/INN);
Tasmaderm (TN)
Formula
C23H31NO2
Exact mass
353.2355
Mol weight
353.4977
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01604  Retinol derivative
Remark
ATC code: D10AD05
Efficacy
Keratolytic
Comment
Retinol derivative
Structure map
map07223  Retinoic acid receptor (RAR) and retinoid X receptor (RXR) agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AD Retinoids for topical use in acne
     D10AD05 Motretinide
      D05082  Motretinide (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 56281-36-8
PubChem: 47206809
ChEMBL: CHEMBL519260
LigandBox: D05082
NIKKAJI: J14.532G
LinkDB All DBs
KCF data Show

ATOM        26
            1   C8y C    16.9325  -21.1581
            2   C8y C    16.9325  -22.5672
            3   C8x C    18.1528  -23.2718
            4   C8y C    19.3732  -22.5672
            5   C8y C    19.3732  -21.1581
            6   C8y C    18.1528  -20.4535
            7   O2a O    15.7122  -23.2718
            8   C1a C    14.5089  -22.5769
            9   C2b C    20.6124  -20.4424
            10  C1a C    20.6124  -23.2828
            11  C1a C    18.1528  -19.0446
            12  C2b C    21.8254  -21.1427
            13  C2c C    23.0154  -20.4554
            14  C2b C    24.2172  -21.1492
            15  C1a C    23.0153  -19.0446
            16  C2b C    25.4128  -20.4587
            17  C2b C    26.6117  -21.1509
            18  C2c C    27.8089  -20.4597
            19  C2b C    29.0070  -21.1513
            20  C1a C    27.8090  -19.0446
            21  C5a C    30.2045  -20.4599
            22  N1b N    31.4024  -21.1514
            23  O5a O    30.2046  -19.0446
            24  C1b C    32.6001  -20.4599
            25  C1a C    33.7980  -21.1515
            26  C1a C    15.7180  -20.4569
BOND        26
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1
            8     7   8 1
            9     5   9 1
            10    4  10 1
            11    6  11 1
            12    9  12 2
            13   12  13 1
            14   13  14 2
            15   13  15 1
            16   14  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   18  20 1
            21   19  21 1
            22   21  22 1
            23   21  23 2
            24   22  24 1
            25   24  25 1
            26    1  26 1

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