KEGG   DRUG: Dimethylaminoethyl reserpilinate dihydrochloride
Entry
D01950                      Drug                                   
Name
Dimethylaminoethyl reserpilinate dihydrochloride (JAN);
Paratensiol
Formula
C26H35N3O5. 2HCl
Exact mass
541.211
Mol weight
542.4951
Structure
Simcomp
Class
Cardiovascular agent
 DG01738  Centrally-acting antiadrenergic
  DG01737  Rauwolfia alkaloid
Remark
Same as: C13441
Efficacy
Antihypertensive
Comment
Rauwolfia alkaloid
Interaction
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01738  Centrally-acting antiadrenergic
   DG01737  Rauwolfia alkaloid
    D01950  Dimethylaminoethyl reserpilinate dihydrochloride
Other DBs
CAS: 3735-84-0
PubChem: 7849012
ChEBI: 34716
LigandBox: D01950
NIKKAJI: J220.212C
LinkDB
KCF data

ATOM        36
            1   C8y C    24.0800  -11.3400
            2   C8y C    24.0800  -12.7400
            3   C8x C    25.3400  -13.4400
            4   C8y C    26.5300  -12.7400
            5   C8y C    26.5300  -11.3400
            6   C8x C    25.3400  -10.6400
            7   N4x N    27.8600  -13.2300
            8   C8y C    28.7000  -12.0400
            9   C8y C    27.8600  -10.9200
            10  O2a O    22.8900  -10.6400
            11  C1a C    21.6300  -11.3400
            12  O2a O    22.8900  -13.4400
            13  C1a C    21.6300  -12.7400
            14  C1y C    30.0999  -12.0198
            15  C1x C    30.8263  -13.2369
            16  N1y N    30.7738  -10.8128
            17  C1x C    32.1999  -10.7929
            18  C1x C    30.0491   -9.5984
            19  C1x C    28.6303   -9.6190
            20  C1y C    32.1999  -13.2168
            21  C1y C    32.9111  -11.9859
            22  C2y C    32.9234  -14.4286
            23  C1y C    34.3000  -11.9664
            24  O2x O    35.0186  -13.1715
            25  C2x C    34.3363  -14.3927
            26  C7a C    32.2462  -15.6580
            27  O7a O    30.8700  -15.6860
            28  O6a O    32.9865  -16.8828
            29  C1a C    34.9813  -10.7470
            30  C1b C    30.1973  -16.9078
            31  C1b C    28.7700  -16.9362
            32  N1c N    28.0927  -18.1652
            33  C1a C    26.6700  -18.1930
            34  C1a C    28.8259  -19.3784
            35  X   Cl   23.5200  -16.0300
            36  X   Cl   23.5200  -16.0300
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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    1  10 1
            12   10  11 1
            13    2  12 1
            14   12  13 1
            15    8  14 1
            16   14  15 1
            17   14  16 1
            18   16  17 1
            19   16  18 1
            20   18  19 1
            21   19   9 1
            22   15  20 1
            23   17  21 1
            24   20  22 1
            25   21  23 1
            26   21  20 1
            27   23  24 1
            28   24  25 1
            29   22  25 2
            30   22  26 1
            31   26  27 1
            32   26  28 2
            33   23  29 1 #Down
            34   27  30 1
            35   30  31 1
            36   31  32 1
            37   32  33 1
            38   32  34 1
BRACKET     1    22.0500  -16.8000   22.0500  -15.0500
            1    24.2900  -15.0500   24.2900  -16.8000
            1  2
 ORIGINAL  1   38
 REPEAT    1   39

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