KEGG   DRUG: Desvenlafaxine succinate anhydrous
Entry
D11619                      Drug                                   
Name
Desvenlafaxine succinate anhydrous
Formula
C16H25NO2. C4H6O4
Exact mass
381.2151
Mol weight
381.46
Structure
Class
Neuropsychiatric agent
 DG01658  Serotonin and norepinephrine reuptake inhibitor (SNRI)
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
 DG02924  UGT substrate
Remark
ATC code: N06AX23
Chemical structure group: DG00963
Product (DG00963): D07793<US> D02570<US>
Efficacy
Antidepressant, Serotonin-noradrenaline reuptake inhibitor (SNRI)
  Disease
Major depressive disorder [DS:H01646]
Target
SLC6A4 (HTT) [HSA:6532] [KO:K05037]
SLC6A2 (NAT1) [HSA:6530] [KO:K05035]
  Pathway
hsa04721  Synaptic vesicle cycle
hsa04726  Serotonergic synapse
Metabolism
Enzyme: UGT [KO:K00699]; CYP3A4 [HSA:1576]
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06A ANTIDEPRESSANTS
    N06AX Other antidepressants
     N06AX23 Desvenlafaxine
      D11619  Desvenlafaxine succinate anhydrous
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01658  Serotonin and norepinephrine reuptake inhibitor (SNRI)
   DG00963  Desvenlafaxine
    D11619  Desvenlafaxine succinate anhydrous
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00963  Desvenlafaxine
     D11619  Desvenlafaxine succinate anhydrous
  DG02924  UGT substrate
   DG00963  Desvenlafaxine
    D11619  Desvenlafaxine succinate anhydrous
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A2 (NAT1)
     D11619  Desvenlafaxine succinate anhydrous
    SLC6A4 (HTT)
     D11619  Desvenlafaxine succinate anhydrous
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D11619
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01658  Serotonin and norepinephrine reuptake inhibitor (SNRI)
   DG00963  Desvenlafaxine
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00963  Desvenlafaxine
  DG02924  UGT substrate
   DG00963  Desvenlafaxine
Other DBs
CAS: 448904-47-0
PubChem: 405226486
LinkDB
KCF data

ATOM        27
            1   O6a O    20.7242  -16.6806
            2   C6a C    21.9752  -15.9856
            3   C1b C    23.1567  -16.6806
            4   C1b C    24.3382  -15.9856
            5   C6a C    25.5197  -16.6806
            6   O6a O    26.7707  -15.9856
            7   O6a O    21.9752  -14.5956
            8   O6a O    25.5197  -18.0707
            9   C8x C    11.7586  -17.1671
            10  C8y C    11.7586  -18.6267
            11  C8x C    12.9401  -19.3217
            12  C8x C    14.1216  -18.6267
            13  C8y C    14.1216  -17.1671
            14  C8x C    12.9401  -16.4721
            15  C1x C    16.6236  -18.6267
            16  C1z C    16.6236  -17.1671
            17  C1c C    15.3031  -16.4721
            18  C1x C    17.8051  -19.3217
            19  C1x C    18.9866  -18.6267
            20  C1x C    18.9866  -17.1671
            21  C1x C    17.8051  -16.4721
            22  O1a O    10.5771  -19.3217
            23  O1a O    16.6236  -15.7771
            24  C1b C    15.3031  -15.0821
            25  N1c N    14.1216  -14.4566
            26  C1a C    12.8706  -15.1516
            27  C1a C    14.1216  -12.9971
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     2   7 2
            7     5   8 2
            8     9  10 2
            9    10  11 1
            10   11  12 2
            11   12  13 1
            12   13  14 2
            13    9  14 1
            14   15  16 1
            15   16  17 1
            16   13  17 1
            17   15  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   16  21 1
            22   10  22 1
            23   16  23 1
            24   17  24 1
            25   24  25 1
            26   25  26 1
            27   25  27 1

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