KEGG   COMPOUND: C00788Help
Entry
C00788                      Compound                               

Name
L-Adrenaline;
(R)-(-)-Adrenaline;
(R)-(-)-Epinephrine;
(R)-(-)-Epirenamine;
(R)-(-)-Adnephrine;
4-[(1R)-1-Hydroxy-2-(methylamino)ethyl]-1,2-benzenediol
Formula
C9H13NO3
Exact mass
183.0895
Mol weight
183.2044
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: D00095
Reaction
Pathway
map00350  Tyrosine metabolism
map01100  Metabolic pathways
map02020  Two-component system
map02024  Quorum sensing
map04024  cAMP signaling pathway
map04080  Neuroactive ligand-receptor interaction
map04261  Adrenergic signaling in cardiomyocytes
map04923  Regulation of lipolysis in adipocytes
map04924  Renin secretion
Module
M00042  Catecholamine biosynthesis, tyrosine => dopamine => noradrenaline => adrenaline
Enzyme
1.4.3.4         2.1.1.6         2.1.1.28
Brite
Compounds with biological roles [BR:br08001]
 Hormones and transmitters
  Other hormones
   Adrenalines
    C00788  Adrenaline
  Neurotransmitters
   Biogenic amines
    C00788  Epinephrine; Adrenaline
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A01 STOMATOLOGICAL PREPARATIONS
   A01A STOMATOLOGICAL PREPARATIONS
    A01AD Other agents for local oral treatment
     A01AD01 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
 B BLOOD AND BLOOD FORMING ORGANS
  B02 ANTIHEMORRHAGICS
   B02B VITAMIN K AND OTHER HEMOSTATICS
    B02BC Local hemostatics
     B02BC09 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
    C01CA Adrenergic and dopaminergic agents
     C01CA24 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AA Sympathomimetics, plain
     R01AA14 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03A ADRENERGICS, INHALANTS
    R03AA Alpha- and beta-adrenoreceptor agonists
     R03AA01 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EA Sympathomimetics in glaucoma therapy
     S01EA01 Epinephrine
      D00095  Epinephrine (USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Bronchodilators, Sympathomimetic
   Epinephrine
    D00095  Epinephrine (USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  24  Hormones
   245  Adrenal hormone preparations
    2451  Epinephrines
     D00095  Epinephrine (USP/INN); Adrenaline (JP17)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Adrenaline (Epinephrine)
    D00095  Epinephrine (USP/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA1
     D00095  Epinephrine (USP/INN) <JP/US>
    ADRA2
     D00095  Epinephrine (USP/INN) <JP/US>
    ADRB
     D00095  Epinephrine (USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00095  Adrenaline
  D00095  Adrenaline solution
  D00095  Adrenaline injection
Drug classes of therapeutic agents [br08360.html]
 Respiratory agents
  D00095
Prodrugs [br08324.html]
 D00095
BRITE hierarchy
Other DBs
CAS: 51-43-4
PubChem: 4046
ChEBI: 28918
ChEMBL: CHEMBL679
KNApSAcK: C00029643
PDB-CCD: ALE[PDBj]
3DMET: B01330
NIKKAJI: J9.224J
KCF data Show

ATOM        13
            1   C8y C    21.2028  -17.0133
            2   C8x C    21.2028  -18.4284
            3   C8x C    19.9857  -16.3144
            4   C1c C    22.4083  -16.3144
            5   C8x C    19.9857  -19.1389
            6   C8y C    18.7742  -17.0133
            7   C1b C    23.6196  -17.0075
            8   O1a O    22.4083  -14.9168
            9   C8y C    18.7742  -18.4284
            10  N1b N    24.8191  -16.3087
            11  O1a O    17.5630  -19.1156
            12  O1a O    17.5677  -16.3165
            13  C1a C    26.0284  -17.0006
BOND        13
            1     1   3 1
            2     1   4 1
            3     2   5 1
            4     3   6 2
            5     4   7 1
            6     4   8 1 #Up
            7     5   9 2
            8     7  10 1
            9     9  11 1
            10    6   9 1
            11    6  12 1
            12    1   2 2
            13   10  13 1

» Japanese version

KEGG   COMPOUND: C00547Help
Entry
C00547                      Compound                               

Name
L-Noradrenaline;
Noradrenaline;
Norepinephrine;
Arterenol;
4-[(1R)-2-Amino-1-hydroxyethyl]-1,2-benzenediol
Formula
C8H11NO3
Exact mass
169.0739
Mol weight
169.1778
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: D00076
Reaction
Pathway
map00350  Tyrosine metabolism
map01100  Metabolic pathways
map02020  Two-component system
map02024  Quorum sensing
map04024  cAMP signaling pathway
map04080  Neuroactive ligand-receptor interaction
map04261  Adrenergic signaling in cardiomyocytes
map04270  Vascular smooth muscle contraction
map04540  Gap junction
map04714  Thermogenesis
map04721  Synaptic vesicle cycle
map04742  Taste transduction
map04923  Regulation of lipolysis in adipocytes
map04924  Renin secretion
map04970  Salivary secretion
Module
M00042  Catecholamine biosynthesis, tyrosine => dopamine => noradrenaline => adrenaline
Enzyme
1.4.3.4         1.14.17.1       2.1.1.6         2.1.1.28
Brite
Compounds with biological roles [BR:br08001]
 Hormones and transmitters
  Other hormones
   Adrenalines
    C00547  Noradrenaline
  Neurotransmitters
   Biogenic amines
    C00547  Norepinephrine; Noradrenaline
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
    C01CA Adrenergic and dopaminergic agents
     C01CA03 Norepinephrine
      D00076  Noradrenaline (JP17) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  24  Hormones
   245  Adrenal hormone preparations
    2451  Epinephrines
     D00076  Noradrenaline (JP17); Norepinephrine (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA1
     D00076  Noradrenaline (JP17) <JP>
    ADRA2
     D00076  Noradrenaline (JP17) <JP>
    ADRB
     D00076  Noradrenaline (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00076  Noradrenaline
  D00076  Noradrenaline injection
BRITE hierarchy
Other DBs
CAS: 51-41-2
PubChem: 3828
ChEBI: 18357
ChEMBL: CHEMBL1437
KNApSAcK: C00001424
PDB-CCD: E5E[PDBj] LNR[PDBj]
3DMET: B01285
NIKKAJI: J9.223A
KCF data Show

ATOM        12
            1   C8y C    25.1107  -17.0137
            2   C8x C    25.1107  -18.4285
            3   C8x C    23.8950  -16.3188
            4   C1c C    26.3149  -16.3188
            5   C8x C    23.8950  -19.1423
            6   C8y C    22.6850  -17.0137
            7   C1b C    27.5246  -17.0080
            8   O1a O    26.3149  -14.9217
            9   C8y C    22.6850  -18.4285
            10  N1a N    28.7227  -16.3130
            11  O1a O    21.4681  -19.1189
            12  O1a O    21.4728  -16.3208
BOND        12
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 1 #Up
            8     5   9 2
            9     7  10 1
            10    9  11 1
            11    6   9 1
            12    6  12 1

» Japanese version

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