KEGG   DRUG: Benserazide hydrochlorideHelp
Entry
D01653                      Drug                                   

Name
Benserazide hydrochloride (JP17)
Formula
C10H15N3O5. HCl
Exact mass
293.0778
Mol weight
293.7041
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01967  Antiparkinson agent
Other
 DG01617  Catecholamine synthesis inhibitors
Remark
Chemical structure group: DG01296
Product (mixture): D02135<JP>
Efficacy
Antiparkinsonian, Decarboxylase inhibitor
Comment
Peripheral aromatic L-amino acid decarboxylase inhibitors (DCI)
Target
DDC [HSA:1644] [KO:K01593]
  Pathway
hsa04726  Serotonergic synapse
hsa04728  Dopaminergic synapse
Interaction
Drug interaction
Structure map
map07057  Antiparkinsonian agents
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Lyases (EC4)
   Carboxy-lyases
    DDC
     D01653  Benserazide hydrochloride (JP17)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01653  Benserazide hydrochloride
BRITE hierarchy
Other DBs
CAS: 14919-77-8
PubChem: 7848716
ChEBI: 31262
ChEMBL: CHEMBL1255778
LigandBox: D01653
NIKKAJI: J369.099G
LinkDB All DBs
KCF data Show

ATOM        19
            1   C8y C    23.9725  -16.2472
            2   C8y C    23.9725  -17.6495
            3   C8x C    25.1899  -18.3506
            4   C8x C    26.4001  -17.6495
            5   C8y C    26.4001  -16.2472
            6   C8y C    25.1899  -15.5461
            7   O1a O    25.1916  -14.1437
            8   O1a O    22.7584  -15.5454
            9   O1a O    22.7584  -18.3513
            10  C1b C    27.6057  -15.5532
            11  N1b N    28.8168  -16.2543
            12  N1b N    30.0278  -15.5602
            13  C5a C    31.2389  -16.2613
            14  C1c C    32.4500  -15.5673
            15  C1b C    33.6610  -16.2685
            16  O1a O    34.8721  -15.5745
            17  O5a O    31.2359  -17.6636
            18  N1a N    32.4530  -14.1649
            19  X   Cl   34.9641  -18.5135
BOND        18
            1     2   9 1
            2     2   3 1
            3     5  10 1
            4     3   4 2
            5    10  11 1
            6     4   5 1
            7    11  12 1
            8     5   6 2
            9    12  13 1
            10    6   1 1
            11   13  14 1
            12   14  15 1
            13    6   7 1
            14   15  16 1
            15   13  17 2
            16    1   8 1
            17   14  18 1
            18    1   2 2

» Japanese version   » Back

KEGG   DRUG: BenserazideHelp
Entry
D03082                      Drug                                   

Name
Benserazide (USAN/INN)
Formula
C10H15N3O5
Exact mass
257.1012
Mol weight
257.2432
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01967  Antiparkinson agent
Other
 DG01617  Catecholamine synthesis inhibitors
Remark
Chemical structure group: DG01296
Efficacy
Antiparkinsonian, Decarboxylase inhibitor
Comment
Peripheral aromatic L-amino acid decarboxylase inhibitors (DCI)
Target
DDC [HSA:1644] [KO:K01593]
  Pathway
hsa04726  Serotonergic synapse
hsa04728  Dopaminergic synapse
Interaction
Drug interaction
Structure map
map07057  Antiparkinsonian agents
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Lyases (EC4)
   Carboxy-lyases
    DDC
     D03082  Benserazide (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 322-35-0
PubChem: 17397237
ChEBI: 64187
ChEMBL: CHEMBL1096979
LigandBox: D03082
NIKKAJI: J276.221H
LinkDB All DBs
KCF data Show

ATOM        18
            1   C8y C    20.1225  -25.1372
            2   C8y C    20.1225  -26.5395
            3   C8x C    21.3399  -27.2406
            4   C8x C    22.5501  -26.5395
            5   C8y C    22.5501  -25.1372
            6   C8y C    21.3399  -24.4361
            7   O1a O    21.3416  -23.0337
            8   O1a O    18.9084  -24.4354
            9   O1a O    18.9084  -27.2413
            10  C1b C    23.7557  -24.4432
            11  N1b N    24.9668  -25.1443
            12  N1b N    26.1778  -24.4502
            13  C5a C    27.3889  -25.1513
            14  C1c C    28.6000  -24.4573
            15  C1b C    29.8110  -25.1585
            16  O1a O    31.0221  -24.4645
            17  O5a O    27.3859  -26.5536
            18  N1a N    28.6030  -23.0549
BOND        18
            1     2   9 1
            2     2   3 1
            3     5  10 1
            4     3   4 2
            5    10  11 1
            6     4   5 1
            7    11  12 1
            8     5   6 2
            9    12  13 1
            10    6   1 1
            11   13  14 1
            12   14  15 1
            13    6   7 1
            14   15  16 1
            15   13  17 2
            16    1   8 1
            17   14  18 1
            18    1   2 2

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