KEGG   COMPOUND: C07463Help
Entry
C07463                      Compound                               

Name
Terfenadine
Formula
C32H41NO2
Exact mass
471.3137
Mol weight
471.6734
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R06 ANTIHISTAMINES FOR SYSTEMIC USE
   R06A ANTIHISTAMINES FOR SYSTEMIC USE
    R06AX Other antihistamines for systemic use
     R06AX12 Terfenadine
      D00521  Terfenadine (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    H1-receptor
     Terfenadine
      D00521  Terfenadine (JAN/USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Terfenadine
    D00521  Terfenadine (JAN/USAN/INN)
  CYP3A5
   Terfenadine
    D00521  Terfenadine (JAN/USAN/INN)
  CYP3A7
   Terfenadine
    D00521  Terfenadine (JAN/USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
50679-08-8
PubChem: 
NIKKAJI: 
KCF data Show

ATOM        35
            1   C8x C    25.4100  -20.3000
            2   C8x C    25.4100  -21.7000
            3   C8x C    26.6000  -22.4000
            4   C8x C    27.8600  -21.7000
            5   C8y C    27.8600  -20.3000
            6   C8x C    26.6000  -19.6000
            7   C8x C    30.2400  -21.7000
            8   C8y C    30.2400  -20.3000
            9   C1d C    29.0500  -19.6000
            10  C8x C    31.5000  -22.4000
            11  C8x C    32.6900  -21.7000
            12  C8x C    32.6900  -20.3000
            13  C8x C    31.5000  -19.6000
            14  C1y C    29.0500  -18.2000
            15  C1x C    30.2400  -17.5000
            16  C1x C    30.2400  -16.1000
            17  N1y N    29.0500  -15.4000
            18  C1x C    27.8600  -16.1000
            19  C1x C    27.8600  -17.5000
            20  O1a O    27.8600  -18.9000
            21  C1b C    29.0500  -14.0000
            22  C1b C    30.3100  -13.3000
            23  C1b C    31.5000  -14.0000
            24  C1c C    32.6900  -13.3000
            25  C8y C    33.8800  -14.0000
            26  O1a O    32.6900  -11.9000
            27  C8x C    33.8800  -15.4000
            28  C8x C    35.0700  -16.1000
            29  C8y C    36.2600  -15.4000
            30  C8x C    36.2600  -14.0000
            31  C8x C    35.0700  -13.3000
            32  C1d C    37.5200  -16.1000
            33  C1a C    38.7100  -16.8000
            34  C1a C    36.8200  -17.3600
            35  C1a C    38.2200  -14.9100
BOND        38
            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     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    9  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   14  19 1
            22    9  20 1
            23   17  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   24  26 1
            29   25  27 2
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   30  31 2
            34   25  31 1
            35   29  32 1
            36   32  33 1
            37   32  34 1
            38   32  35 1

» Japanese version

DBGET integrated database retrieval system