KEGG   COMPOUND: C05853
Entry
C05853                      Compound                               
Name
Phenylethyl alcohol;
Phenethyl alcohol;
2-Phenylethanol
Formula
C8H10O
Exact mass
122.0732
Mol weight
122.1644
Structure
Remark
Same as: D00192
Reaction
R02611
Pathway
map00360  Phenylalanine metabolism
Enzyme
1.1.1.90
Other DBs
CAS: 60-12-8
PubChem: 8146
ChEBI: 49000
KNApSAcK: C00002663
PDB-CCD: PEL[PDBj]
3DMET: B00869
NIKKAJI: J1.924K
LinkDB
KCF data

ATOM        9
            1   C8y C    24.0158  -19.9151
            2   C8x C    22.7903  -20.6155
            3   C8x C    24.0217  -18.5145
            4   C1b C    25.2181  -20.6212
            5   C8x C    21.5881  -19.9035
            6   C8x C    22.8079  -17.8141
            7   C1b C    26.4261  -19.9094
            8   C8x C    21.5939  -18.5028
            9   O1a O    27.6342  -20.6097
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     7   9 1
            9     6   8 2

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