KEGG   COMPOUND: C05332
Entry
C05332                      Compound                               

Name
Phenethylamine;
2-Phenylethylamine;
beta-Phenylethylamine;
Phenylethylamine
Formula
C8H11N
Exact mass
121.0891
Mol weight
121.1796
Structure
Reaction
Pathway
map00360  Phenylalanine metabolism
map01100  Metabolic pathways
Enzyme
1.4.3.4         1.4.3.21        1.4.9.2         3.5.1.85        
4.1.1.28        4.1.1.53
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amines
   Biogenic amines
    C05332  Phenethylamine
Other DBs
CAS: 64-04-0
PubChem: 7711
ChEBI: 18397
ChEMBL: CHEMBL610
KNApSAcK: C00001426
PDB-CCD: PEA[PDBj]
3DMET: B00766
NIKKAJI: J4.833J
KCF data

ATOM        9
            1   C8y C    24.3600  -16.9400
            2   C8x C    23.1700  -16.2400
            3   C8x C    24.3600  -18.3400
            4   C8x C    21.9800  -16.9400
            5   C8x C    23.1700  -19.0400
            6   C8x C    21.9800  -18.3400
            7   C1b C    25.5724  -16.2400
            8   C1b C    26.7849  -16.9400
            9   N1a N    27.9973  -16.2400
BOND        9
            1     1   2 1
            2     1   3 2
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     5   6 2
            7     1   7 1
            8     7   8 1
            9     8   9 1

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