KEGG   DRUG: DeutetrabenazineHelp
Entry
D10701                      Drug                                   

Name
Deutetrabenazine (USAN/INN)
Product
Formula
C19H27NO3
Exact mass
323.2368
Mol weight
317.4226
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Product: D10701<US>
Efficacy
Neuroleptic, Vesicular monoamine transporter inhibitor
Comment
Treatment of chorea associated with Huntington disease
Target
SLC18A2 (VMAT2) [HSA:6571] [KO:K08155]
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC18
    SLC18A2 (VMAT2)
     D10701  Deutetrabenazine (USAN/INN) <US>
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D10701
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10701
Pharmacogenomic biomarkers [br08341.html]
 Polymorphisms and germline mutations
  D10701
BRITE hierarchy
Other DBs
CAS: 1392826-25-3
PubChem: 254741662
LinkDB All DBs
KCF data Show

ATOM        23
            1   C8y C    15.6125  -17.0127
            2   C8y C    15.6125  -18.4129
            3   C8x C    16.8027  -19.1130
            4   C8y C    18.0628  -18.4129
            5   C8y C    18.0628  -17.0127
            6   C8x C    16.8027  -16.3126
            7   O2a O    14.4223  -16.3126
            8   O2a O    14.4223  -19.1130
            9   C1x C    19.2530  -19.1130
            10  C1x C    20.4432  -18.4129
            11  N1y N    20.4432  -17.0127
            12  C1y C    19.2530  -16.3126
            13  C1x C    21.7034  -16.3126
            14  C1y C    21.7034  -14.9124
            15  C5x C    20.4432  -14.2123
            16  C1x C    19.2530  -14.9124
            17  C1a C    24.0837  -16.3126
            18  C1c C    24.0837  -14.9124
            19  C1b C    22.8935  -14.2123
            20  C1a C    25.3439  -14.2123
            21  O5x O    20.4432  -12.8121
            22  C1a C    14.4223  -14.9124
            23  C1a C    13.2097  -18.4129
BOND        25
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     2   8 1
            9     4   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13    5  12 1
            14   11  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   12  16 1
            19   17  18 1
            20   18  19 1
            21   14  19 1 #Down
            22   18  20 1
            23   15  21 2
            24    7  22 1
            25    8  23 1

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