KEGG   DRUG: L-Methylephedrine hydrochloride
Entry
D01952                      Drug                                   
Name
L-Methylephedrine hydrochloride (JAN)
Formula
C11H17NO. HCl
Exact mass
215.1077
Mol weight
215.7197
Structure
Simcomp
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
Remark
Chemical structure group: DG01229
Product (DG01229): D02109<JP>
Efficacy
Bronchodilator, Adrenergic receptor agonist
Comment
Phenethylamine derivative
Target
ADRA1 [HSA:148 147 146] [KO:K04135 K04136 K04137]
ADRA2 [HSA:150 151 152] [KO:K04138 K04139 K04140]
ADRB [HSA:153 154 155] [KO:K04141 K04142 K04143]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
hsa04970  Salivary secretion
Interaction
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01456  Adrenergic receptor agonist
   DG01229  Methylephedrine
    D01952  L-Methylephedrine hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA1
     D01952  L-Methylephedrine hydrochloride (JAN)
    ADRA2
     D01952  L-Methylephedrine hydrochloride (JAN)
    ADRB
     D01952  L-Methylephedrine hydrochloride (JAN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01456  Adrenergic receptor agonist
   DG01229  Methylephedrine
Other DBs
CAS: 38455-90-2
PubChem: 7849014
LigandBox: D01952
NIKKAJI: J299.262K
KCF data

ATOM        14
            1   C8x C    26.1800  -17.1500
            2   C8x C    26.1800  -18.5500
            3   C8x C    27.3700  -19.3200
            4   C8x C    28.5600  -18.5500
            5   C8y C    28.5600  -17.1500
            6   C8x C    27.3700  -16.4500
            7   C1c C    29.8200  -16.4500
            8   C1c C    31.0100  -17.1500
            9   N1c N    32.2000  -16.4500
            10  C1a C    33.4600  -17.1500
            11  C1a C    31.0100  -18.5500
            12  O1a O    29.8200  -15.0500
            13  C1a C    32.2000  -15.0500
            14  X   Cl   37.9400  -16.9400
BOND        13
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    8  11 1 #Up
            12    7  12 1 #Up
            13    9  13 1

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