KEGG   COMPOUND: C06860
Entry
C06860                      Compound                               
Name
Bupropion
Formula
C13H18ClNO
Exact mass
239.1077
Mol weight
239.74
Structure
Remark
Same as: D07591
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06A ANTIDEPRESSANTS
    N06AX Other antidepressants
     N06AX12 Bupropion
      D07591  Bupropion (INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG03059  Noradrenalin and dopamine reuptake inhibitor (NDRI)
   DG00957  Bupropion
    D07591  Bupropion
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A2 (NAT1)
     D07591  Bupropion (INN)
    SLC6A3 (DAT1)
     D07591  Bupropion (INN)
Other DBs
CAS: 34841-39-9
PubChem: 9078
ChEBI: 3219
NIKKAJI: J32.840E
KCF data

ATOM        16
            1   C8y C    17.4300  -16.1700
            2   C5a C    18.6200  -15.4700
            3   C8x C    16.1700  -15.4700
            4   C8x C    17.4300  -17.5700
            5   C1c C    19.8100  -16.1700
            6   O5a O    18.6200  -14.0700
            7   C8y C    14.9800  -16.1700
            8   C8x C    16.1700  -18.2700
            9   N1b N    21.0000  -15.4700
            10  C1a C    19.8100  -17.5700
            11  C8x C    14.9800  -17.5700
            12  X   Cl   13.7900  -15.4700
            13  C1d C    22.2600  -16.1700
            14  C1a C    23.4500  -15.4700
            15  C1a C    22.2600  -17.5700
            16  C1a C    23.4500  -16.9400
BOND        16
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 1
            10    7  11 2
            11    7  12 1
            12    9  13 1
            13   13  14 1
            14   13  15 1
            15   13  16 1
            16    8  11 1

» Japanese version

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Drug (1)   
   KEGG DRUG (1)   
Chemical substance (9)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   MASSBANK (5)   
   NIKKAJI (1)   
All databases (10)   

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