KEGG   DRUG: Benoxinate hydrochloride
Entry
D01768                      Drug                                   
Name
Benoxinate hydrochloride (USP);
Oxybuprocaine hydrochloride (JP18);
Benoxil (TN)
Formula
C17H28N2O3. HCl
Exact mass
344.1867
Mol weight
344.8768
Structure
Simcomp
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG01675  Local anesthetic
Remark
Therapeutic category: 1313
ATC code: D04AB03 S01HA02
Chemical structure group: DG00392
Product (DG00392): D01768<JP>
Product (mixture): D11645<US>
Efficacy
Anesthetic (topical)
Target
SCN1A [HSA:6323] [KO:K04833]
SCN2A [HSA:6326] [KO:K04834]
SCN3A [HSA:6328] [KO:K04836]
SCN4A [HSA:6329] [KO:K04837]
SCN5A [HSA:6331] [KO:K04838]
SCN8A [HSA:6334] [KO:K04840]
SCN9A [HSA:6335] [KO:K04841]
SCN10A [HSA:6336] [KO:K04842]
SCN11A [HSA:11280] [KO:K04843]
  Pathway
hsa04728  Dopaminergic synapse
Interaction
Structure map
map07015  Local analgesics
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D04 ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC.
   D04A ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC.
    D04AB Anesthetics for topical use
     D04AB03 Oxybuprocaine
      D01768  Benoxinate hydrochloride (USP) <JP>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01H LOCAL ANESTHETICS
    S01HA Local anesthetics
     S01HA02 Oxybuprocaine
      D01768  Benoxinate hydrochloride (USP) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  13  Agents affecting sensory organs
   131  Ophthalmic agents
    1313  Ophthalmic local anesthetics
     D01768  Benoxinate hydrochloride (USP); Oxybuprocaine hydrochloride (JP18)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG00392  Oxybuprocaine
     D01768  Benoxinate hydrochloride
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Sodium channels
    SCN1A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN2A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN3A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN4A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN5A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN8A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN9A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN10A
     D01768  Benoxinate hydrochloride (USP) <JP>
    SCN11A
     D01768  Benoxinate hydrochloride (USP) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01768  Oxybuprocaine hydrochloride
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG00392  Oxybuprocaine
Other DBs
CAS: 5987-82-6
PubChem: 7848831
ChEBI: 31260
LigandBox: D01768
NIKKAJI: J231.218B
LinkDB
KCF data

ATOM        23
            1   C8y C    29.6264  -16.7756
            2   C8y C    29.6264  -15.3737
            3   C8x C    30.8434  -14.6727
            4   C8x C    32.0533  -15.3737
            5   C8y C    32.0533  -16.7756
            6   C8x C    30.8434  -17.4765
            7   C7a C    33.2586  -17.4765
            8   O7a O    34.4693  -16.7756
            9   C1b C    35.6801  -17.4765
            10  C1b C    36.8908  -16.7756
            11  N1c N    38.1015  -17.4765
            12  C1b C    39.3123  -16.7756
            13  C1a C    40.5230  -17.4765
            14  O6a O    33.2572  -18.8784
            15  C1b C    38.1015  -18.8784
            16  C1a C    39.3157  -19.5794
            17  N1a N    28.4126  -14.6720
            18  O2a O    28.4126  -17.4770
            19  C1b C    27.1978  -16.7825
            20  C1b C    25.9870  -17.4835
            21  C1b C    24.7763  -16.7897
            22  C1a C    23.5656  -17.4906
            23  X   Cl   40.0158  -14.7191
BOND        22
            1    10  11 1
            2     4   5 1
            3    11  12 1
            4     5   6 2
            5    12  13 1
            6     6   1 1
            7     7  14 2
            8    11  15 1
            9     5   7 1
            10   15  16 1
            11    2  17 1
            12    7   8 1
            13    1  18 1
            14    1   2 2
            15   18  19 1
            16    8   9 1
            17   19  20 1
            18    2   3 1
            19   20  21 1
            20    9  10 1
            21   21  22 1
            22    3   4 2

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