KEGG   DRUG: Oxetacaine hydrochloride
Entry
D08311                      Drug                                   
Name
Oxetacaine hydrochloride;
Emoren (TN)
Formula
C28H41N3O3. HCl
Exact mass
503.2915
Mol weight
504.1044
Structure
Simcomp
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG01675  Local anesthetic
   DG01673  Amide type local anesthetic
Gastrointestinal agent
 DG01975  Agents for peptic ulcer
Remark
ATC code: C05AD06
Chemical structure group: DG00299
Product (DG00299): D01152<JP>
Efficacy
Anesthetic (local), Anti-ulcerative
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
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C05 VASOPROTECTIVES
   C05A AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
    C05AD Local anesthetics
     C05AD06 Oxetacaine
      D08311  Oxetacaine hydrochloride
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG01673  Amide type local anesthetic
     DG00299  Oxetacaine
      D08311  Oxetacaine hydrochloride
 Gastrointestinal agent
  DG01975  Agents for peptic ulcer
   DG00299  Oxetacaine
    D08311  Oxetacaine hydrochloride
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Sodium channels
    SCN1A
     D08311  Oxetacaine hydrochloride
    SCN2A
     D08311  Oxetacaine hydrochloride
    SCN3A
     D08311  Oxetacaine hydrochloride
    SCN4A
     D08311  Oxetacaine hydrochloride
    SCN5A
     D08311  Oxetacaine hydrochloride
    SCN8A
     D08311  Oxetacaine hydrochloride
    SCN9A
     D08311  Oxetacaine hydrochloride
    SCN10A
     D08311  Oxetacaine hydrochloride
    SCN11A
     D08311  Oxetacaine hydrochloride
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG01675  Local anesthetic
    DG01673  Amide type local anesthetic
     DG00299  Oxetacaine
 Gastrointestinal agent
  DG01975  Agents for peptic ulcer
   DG00299  Oxetacaine
Other DBs
CAS: 13930-31-9
PubChem: 96024998
LigandBox: D08311
NIKKAJI: J281.135I
LinkDB
KCF data

ATOM        35
            1   N1c N    14.8996  -16.2290
            2   C1b C    13.5123  -16.2290
            3   C1b C    15.5933  -14.8416
            4   C5a C    17.0499  -14.8416
            5   N1c N    17.6742  -13.6624
            6   C1d C    18.9922  -13.6624
            7   C1a C    16.9111  -12.3442
            8   C1b C    19.6859  -12.4832
            9   C1a C    18.9920  -15.1885
            10  C1a C    20.1714  -14.3561
            11  C8y C    21.0732  -12.4832
            12  C8x C    21.7669  -13.7318
            13  C8x C    23.1542  -13.7318
            14  C8x C    23.8479  -12.5526
            15  C8x C    23.1542  -11.3039
            16  C8x C    21.7669  -11.3039
            17  C1b C    12.8880  -15.0497
            18  O1a O    11.5007  -15.0497
            19  C1b C    15.5933  -17.6163
            20  C5a C    16.9806  -17.6163
            21  N1c N    17.6742  -18.7955
            22  C1d C    18.9922  -18.7955
            23  C1b C    19.6859  -19.9747
            24  C1a C    16.7720  -20.0443
            25  C1a C    18.9922  -16.9920
            26  C1a C    20.1714  -18.1019
            27  C8y C    21.0732  -19.9747
            28  C8x C    21.7669  -21.1540
            29  C8x C    23.1542  -21.1540
            30  C8x C    23.7786  -19.9747
            31  C8x C    23.0848  -18.7955
            32  C8x C    21.7669  -18.7955
            33  O5a O    17.9517  -15.6740
            34  O5a O    17.8824  -16.7839
            35  X   Cl   25.8595  -16.7146
BOND        35
            1     2  17 1
            2     6   9 1
            3    17  18 1
            4     4   5 1
            5     1  19 1
            6     6  10 1
            7    19  20 1
            8     1   3 1
            9    20  21 1
            10    8  11 1
            11   21  22 1
            12    5   6 1
            13   22  23 1
            14    1   2 1
            15   21  24 1
            16    5   7 1
            17   22  25 1
            18    3   4 1
            19   22  26 1
            20    6   8 1
            21   23  27 1
            22   11  12 2
            23   12  13 1
            24   13  14 2
            25   14  15 1
            26   15  16 2
            27   27  28 2
            28   28  29 1
            29   29  30 2
            30   30  31 1
            31   31  32 2
            32   32  27 1
            33   16  11 1
            34    4  33 2
            35   20  34 2

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