KEGG   DRUG: RacepinephrineHelp
Entry
D05688                      Drug                                   

Name
Racepinephrine (USP/INN)
Formula
C9H13NO3
Exact mass
183.0895
Mol weight
183.2044
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01951  Catecholamine adrenergic receptor agonist
Remark
Chemical structure group: DG01444
Efficacy
Bronchodilator
Comment
Catecholamine 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
hsa04022  cGMP-PKG signaling pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA1
     D05688  Racepinephrine (USP/INN)
    ADRA2
     D05688  Racepinephrine (USP/INN)
    ADRB
     D05688  Racepinephrine (USP/INN)
BRITE hierarchy
Other DBs
CAS: 329-65-7
PubChem: 47207349
ChEMBL: CHEMBL1740
LigandBox: D05688
NIKKAJI: J237.495A
KCF data Show

ATOM        13
            1   C8y C    15.8200  -16.7300
            2   C8y C    15.8200  -18.1300
            3   C8x C    17.0324  -18.8300
            4   C8x C    18.2449  -18.1300
            5   C8y C    18.2449  -16.7300
            6   C8x C    17.0324  -16.0300
            7   O1a O    14.6076  -18.8300
            8   O1a O    14.6076  -16.0300
            9   C1c C    19.4760  -16.0190
            10  C1b C    20.6812  -16.7147
            11  N1b N    21.8635  -16.0319
            12  O1a O    19.4757  -14.6301
            13  C1a C    23.0575  -16.7212
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     2   7 1
            8     1   8 1
            9     5   9 1
            10    9  10 1
            11   10  11 1
            12    9  12 1
            13   11  13 1

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