KEGG   DRUG: Etryptamine acetate
Entry
D04092                      Drug                                   

Name
Etryptamine acetate (USAN)
Formula
C12H16N2. C2H4O2
Exact mass
248.1525
Mol weight
248.3208
Structure
Class
Neuropsychiatric agent
 DG01568  MAO inhibitor
  DG01519  Non-selective monoamine oxidase inhibitor
Efficacy
Stimulant (central), Monoamine oxidase (MAO) inhibitor
Target
MAO [HSA:4128 4129] [KO:K00274]
  Pathway
hsa00982  Drug metabolism - cytochrome P450
hsa04726  Serotonergic synapse
hsa04728  Dopaminergic synapse
Interaction
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Amine oxidases
    MAO
     D04092  Etryptamine acetate (USAN)
Other DBs
CAS: 118-68-3
PubChem: 17398024
ChEMBL: CHEMBL1412355
DrugBank: DB01546
LigandBox: D04092
NIKKAJI: J300.492I
LinkDB
KCF data

ATOM        18
            1   C8y C    26.7946  -14.0443
            2   C8y C    28.1277  -14.5354
            3   C8y C    26.7946  -12.6410
            4   C8x C    25.6018  -14.7459
            5   C8x C    28.9697  -13.4128
            6   N4x N    28.1979  -12.2200
            7   C8x C    25.6018  -11.9394
            8   C8x C    24.4090  -14.0443
            9   C8x C    24.4090  -12.6410
            10  C1b C    28.1277  -15.9354
            11  C1c C    29.3600  -16.6467
            12  C1b C    30.5440  -15.9627
            13  C1a C    31.7373  -16.6515
            14  N1a N    29.3606  -18.0597
            15  C6a C    34.4483  -13.4884
            16  O6a O    35.6635  -14.1900
            17  C1a C    33.2331  -14.1900
            18  O6a O    34.4483  -12.0851
BOND        18
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     7   9 2
            9     5   6 1
            10    8   9 1
            11    2  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15   11  14 1
            16   15  16 1
            17   15  17 1
            18   15  18 2

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