KEGG   DRUG: Buphenine
Entry
D07551                      Drug                                   
Name
Buphenine (INN)
Formula
C19H25NO2
Exact mass
299.1885
Mol weight
299.41
Structure
Simcomp
Remark
ATC code: C04AA02 G02CA02
Chemical structure group: DG00278
Efficacy
Vasodilator (peripheral)
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C04 PERIPHERAL VASODILATORS
   C04A PERIPHERAL VASODILATORS
    C04AA 2-amino-1-phenylethanol derivatives
     C04AA02 Buphenine
      D07551  Buphenine (INN)
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G02 OTHER GYNECOLOGICALS
   G02C OTHER GYNECOLOGICALS
    G02CA Sympathomimetics, labour repressants
     G02CA02 Buphenine
      D07551  Buphenine (INN)
Other DBs
CAS: 447-41-6
PubChem: 51091873
LigandBox: D07551
NIKKAJI: J5.749E
LinkDB
KCF data

ATOM        22
            1   C8y C    23.5200  -16.5900
            2   C8x C    24.7100  -15.8900
            3   C8x C    25.9700  -16.5200
            4   C8x C    25.9700  -17.9200
            5   C8x C    24.7100  -18.6200
            6   C8x C    23.5200  -17.9900
            7   C8x C    12.5300  -15.8200
            8   C8y C    12.5300  -14.4200
            9   C8x C    13.7900  -13.7200
            10  C8x C    14.9800  -14.4200
            11  C8y C    14.9800  -15.8200
            12  C8x C    13.7900  -16.5200
            13  C1c C    16.1700  -16.5200
            14  C1c C    17.4300  -15.8200
            15  N1b N    18.6200  -16.5200
            16  C1c C    19.8800  -15.8200
            17  C1b C    21.0700  -16.5200
            18  C1b C    22.3300  -15.8900
            19  O1a O    11.3400  -13.7200
            20  O1a O    16.1700  -17.9200
            21  C1a C    17.4300  -14.4200
            22  C1a C    19.8800  -14.4200
BOND        23
            1    10  11 1
            2    11  12 2
            3    12   7 1
            4     5   6 2
            5    11  13 1
            6     6   1 1
            7    13  14 1
            8    14  15 1
            9    15  16 1
            10    1   2 2
            11   16  17 1
            12    2   3 1
            13   17  18 1
            14   18   1 1
            15    3   4 2
            16    8  19 1
            17    4   5 1
            18   13  20 1
            19    7   8 2
            20   14  21 1
            21    8   9 1
            22   16  22 1
            23    9  10 2

» Japanese version   » Back

DBGET integrated database retrieval system