KEGG   COMPOUND: C07490
Entry
C07490                      Compound                               
Name
Trichloroethanol;
2,2,2-Trichloroethanol
Formula
C2H3Cl3O
Exact mass
147.9249
Mol weight
149.40
Structure
Reaction
R07105 R07106 R07107 R09148 R09149
Pathway
map00625  Chloroalkane and chloroalkene degradation
map00980  Metabolism of xenobiotics by cytochrome P450
map01120  Microbial metabolism in diverse environments
map07032  Hypnotics
Enzyme
1.1.1.1         1.1.-.-         1.14.13.25      1.14.14.-       
2.4.1.17
Other DBs
CAS: 115-20-8
PubChem: 9693
ChEBI: 28094
PDB-CCD: 8FH[PDBj]
NIKKAJI: J2.895I
LinkDB
KCF data

ATOM        6
            1   C1d C    28.2277  -16.9168
            2   C1b C    29.4405  -17.6165
            3   X   Cl   27.0148  -17.6165
            4   X   Cl   28.2277  -15.5174
            5   X   Cl   28.2218  -18.3220
            6   O1a O    30.6474  -16.9168
BOND        5
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1

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