KEGG   DRUG: Tolvaptan sodium phosphate
Entry
D11659                      Drug                                   
Name
Tolvaptan sodium phosphate (JAN);
Samtasu (TN)
Formula
C26H24ClN2O6P. 2Na
Exact mass
572.0856
Mol weight
572.8849
Structure
Class
Cardiovascular agent
 DG01506  Arginine vasopressin receptor 2 (AVPR2) antagonist
Remark
Therapeutic category: 2139
ATC code: C03XA01
Chemical structure group: DG03074
Product (DG03074): D01213<JP/US> D11659<JP>
Efficacy
Diuretic, Vasopressin V2 receptor antagonist
Target
AVPR2 [HSA:554] [KO:K04228]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04962  Vasopressin-regulated water reabsorption
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C03 DIURETICS
   C03X OTHER DIURETICS
    C03XA Vasopressin antagonists
     C03XA01 Tolvaptan
      D11659  Tolvaptan sodium phosphate (JAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   213  Diuretics
    2139  Others
     D11659  Tolvaptan sodium phosphate (JAN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01506  Arginine vasopressin receptor 2 (AVPR2) antagonist
   DG03074  Tolvaptan
    D11659  Tolvaptan sodium phosphate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Vasopressin
    AVPR2
     D11659  Tolvaptan sodium phosphate (JAN) <JP>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D11659
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11659
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01506  Arginine vasopressin receptor 2 (AVPR2) antagonist
   DG03074  Tolvaptan
Other DBs
PubChem: 405226526
LinkDB
KCF data

ATOM        38
            1   C1x C    12.7280  -16.5743
            2   C1x C    11.8888  -15.4554
            3   C1x C    12.2384  -14.1266
            4   C1y C    13.4972  -13.5672
            5   N1y N    14.1266  -16.5743
            6   C8y C    14.7560  -14.1966
            7   C8y C    15.0358  -15.5253
            8   C8x C    16.3645  -15.9449
            9   C8x C    17.4135  -15.0358
            10  C8y C    17.1338  -13.6371
            11  C8x C    15.8051  -13.2175
            12  O2b O    13.4972  -12.1685
            13  X   Cl   18.1828  -12.7280
            14  O5a O    14.1266  -19.0220
            15  C5a C    14.8260  -17.8331
            16  C8y C    16.2247  -17.8331
            17  C8y C    16.9240  -19.0220
            18  C8x C    18.3227  -19.0220
            19  C8y C    19.0220  -17.7632
            20  C8x C    18.3227  -16.5743
            21  C8x C    16.9240  -16.5743
            22  C1a C    16.2247  -20.2109
            23  N1b N    20.4906  -17.7632
            24  C5a C    21.1900  -16.5743
            25  C8y C    22.5886  -16.5743
            26  O5a O    20.4906  -15.3854
            27  C8y C    23.2880  -17.8331
            28  C8x C    24.6866  -17.8331
            29  C8x C    25.3860  -16.5743
            30  C8x C    24.6866  -15.3854
            31  C8x C    23.2880  -15.3854
            32  C1a C    22.5886  -19.0220
            33  P1b P    13.4972  -10.7685
            34  O1c O    13.4972   -9.3685 #-
            35  O1c O    12.0972  -10.7685
            36  O1c O    14.8972  -10.7685 #-
            37  Z   Na   17.2900  -10.6400 #+
            38  Z   Na   16.1000   -9.1000 #+
BOND        39
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    6  11 2
            13    4  12 1 #Up
            14   10  13 1
            15   14  15 2
            16    5  15 1
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 2
            23   16  21 1
            24   17  22 1
            25   19  23 1
            26   23  24 1
            27   24  25 1
            28   24  26 2
            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   27  32 1
            36   12  33 1
            37   33  34 1
            38   33  35 2
            39   33  36 1

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