KEGG   DRUG: Tianeptine sodium
Entry
D08589                      Drug                                   

Name
Tianeptine sodium;
Stablon (TN)
Formula
C21H24ClN2O4S. Na
Exact mass
458.1043
Mol weight
458.934
Structure
Simcomp
Remark
ATC code: N06AX14
Chemical structure group: DG00958
Efficacy
Antidepressant
Comment
Tricyclic antidepressant
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06A ANTIDEPRESSANTS
    N06AX Other antidepressants
     N06AX14 Tianeptine
      D08589  Tianeptine sodium
Other DBs
CAS: 30123-17-2
PubChem: 96025273
ChEMBL: CHEMBL2361572
LigandBox: D08589
NIKKAJI: J260.562G
LinkDB
KCF data

ATOM        30
            1   S2x S    21.2100  -20.5800
            2   C8y C    20.3700  -19.4600
            3   C8y C    20.7200  -18.1300
            4   C1y C    21.9800  -17.5700
            5   N1y N    22.6100  -20.5800
            6   C8y C    23.2400  -18.1300
            7   C8y C    23.5200  -19.5300
            8   C8x C    19.6700  -17.1500
            9   C8x C    18.3400  -17.5700
            10  C8y C    17.9900  -18.9000
            11  C8x C    19.0400  -19.8800
            12  C8x C    24.8500  -19.9500
            13  C8x C    25.9000  -19.0400
            14  C8x C    25.5500  -17.6400
            15  C8x C    24.2200  -17.2200
            16  X   Cl   16.6600  -19.3200
            17  C1a C    23.3100  -21.8400
            18  O3c O    19.8800  -20.9300
            19  O3c O    21.5600  -21.9100
            20  N1b N    21.9800  -16.1700
            21  C1b C    23.1700  -15.4700
            22  C1b C    24.3600  -16.1700
            23  C1b C    25.6200  -15.4700
            24  C1b C    26.8100  -16.1700
            25  C1b C    28.0700  -15.4000
            26  C1b C    29.2600  -16.1000
            27  C6a C    30.4500  -15.4000
            28  O6a O    31.6400  -16.1000 #-
            29  O6a O    30.4500  -14.0000
            30  Z   Na   34.4400  -16.1000 #+
BOND        31
            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     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    7  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    6  15 2
            18   10  16 1
            19    5  17 1
            20    1  18 2
            21    1  19 2
            22    4  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   27  29 2

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