KEGG   COMPOUND: C00398Help
Entry
C00398                      Compound                               

Name
Tryptamine;
3-(2-Aminoethyl)indole
Formula
C10H12N2
Exact mass
160.1
Mol weight
160.2157
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00380  Tryptophan metabolism
map00901  Indole alkaloid biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map04080  Neuroactive ligand-receptor interaction
Enzyme
1.4.3.4         1.4.3.22        1.14.13.-       1.14.99.59      
2.1.1.49        4.1.1.28        4.1.1.105       4.3.3.2
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C00398  Tryptamine
BRITE hierarchy
Other DBs
CAS: 61-54-1
PubChem: 3688
ChEBI: 16765
ChEMBL: CHEMBL6640
KNApSAcK: C00001434
PDB-CCD: TSS[PDBj]
3DMET: B00104
NIKKAJI: J4.816J
KCF data Show

ATOM        12
            1   C8x C    15.8768  -16.1636
            2   C8x C    15.8768  -17.5631
            3   C8x C    17.0889  -18.2629
            4   C8y C    18.3010  -17.5631
            5   C8y C    18.3010  -16.1636
            6   C8x C    17.0889  -15.4638
            7   N4x N    19.6320  -17.9956
            8   C8x C    20.4547  -16.8633
            9   C8y C    19.6320  -15.7312
            10  C1b C    20.0631  -14.4048
            11  C1b C    21.4421  -14.1117
            12  N1a N    22.3829  -15.1563
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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13   11  12 1

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