KEGG   DRUG: D00198Help
Entry
D00198                      Drug                                   

Name
Rescinnamine (JAN/INN);
Tsuruselpi S (TN)
Formula
C35H42N2O9
Exact mass
634.289
Mol weight
634.716
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antihypertensive
Remark
Same as: 
ATC code: 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C02 ANTIHYPERTENSIVES
   C02A ANTIADRENERGIC AGENTS, CENTRALLY ACTING
    C02AA Rauwolfia alkaloids
     C02AA01 Rescinnamine
      D00198  Rescinnamine (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 
24815-24-5
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        46
            1   C8y C     8.8388   -4.7496
            2   C1y C    10.2358   -4.7496
            3   N1y N    10.9342   -3.5399
            4   C1x C    10.2358   -2.3300
            5   C1x C     8.8388   -2.3300
            6   C8y C     8.1403   -3.5399
            7   C1x C    10.9342   -5.9594
            8   C1y C    12.3312   -5.9594
            9   C1y C    13.0297   -4.7496
            10  C1x C    12.3312   -3.5399
            11  C1y C    13.0297   -7.1693
            12  C1y C    14.4266   -7.1693
            13  C1y C    15.1251   -5.9594
            14  C1x C    14.4266   -4.7496
            15  C8y C     6.6342   -3.8302
            16  C8y C     6.6278   -5.2196
            17  N4x N     7.9040   -5.7878
            18  C8x C     5.4276   -3.1263
            19  C8x C     4.2146   -3.8193
            20  C8y C     4.2083   -5.2085
            21  C8x C     5.4149   -5.9125
            22  O2a O     2.9983   -5.8999
            23  C1a C     1.7574   -5.1764
            24  C7a C    12.3202   -8.3977
            25  O7a O    16.5219   -5.9594
            26  O2a O    15.1361   -8.3977
            27  O6a O    10.9343   -8.3974
            28  O7a O    13.0143   -9.6003
            29  C1a C    12.3328  -10.7799
            30  C1a C    16.5330   -8.3977
            31  C7a C    17.2301   -4.7329
            32  C2b C    18.6174   -4.7331
            33  O6a O    16.5366   -3.5316
            34  C2b C    19.3229   -5.9553
            35  C8y C    20.7199   -5.9555
            36  C8x C    21.4174   -7.1640
            37  C8y C    22.8174   -7.1641
            38  C8y C    23.5175   -5.9518
            39  C8y C    22.8201   -4.7434
            40  C8x C    21.4201   -4.7432
            41  O2a O    24.9175   -5.9520
            42  C1a C    25.6177   -4.7397
            43  C1a C    24.9202   -3.5312
            44  O2a O    23.5202   -3.5310
            45  O2a O    23.5075   -8.3595
            46  C1a C    24.9197   -8.3598
BOND        51
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     2   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    3  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17    6  15 1
            18   15  16 1
            19   16  17 1
            20    1  17 1
            21   15  18 2
            22   18  19 1
            23   19  20 2
            24   20  21 1
            25   16  21 2
            26   20  22 1
            27   22  23 1
            28   11  24 1 #Up
            29   13  25 1 #Up
            30   12  26 1 #Down
            31   24  27 2
            32   24  28 1
            33   28  29 1
            34   26  30 1
            35   25  31 1
            36   31  32 1
            37   31  33 2
            38   32  34 2
            39   34  35 1
            40   35  36 2
            41   36  37 1
            42   37  38 2
            43   38  39 1
            44   39  40 2
            45   35  40 1
            46   38  41 1
            47   41  42 1
            48   43  44 1
            49   39  44 1
            50   37  45 1
            51   45  46 1

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