KEGG   COMPOUND: C06614
Entry
C06614                      Compound                               

Name
trans-3-Chloroacrylic acid
Formula
C3H3ClO2
Exact mass
105.9822
Mol weight
106.5077
Structure
Reaction
Pathway
map00625  Chloroalkane and chloroalkene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.2.1.3         3.8.1.-
Other DBs
CAS: 2345-61-1
PubChem: 8840
ChEBI: 19982
3DMET: B01001
NIKKAJI: J1.807D
KCF data

ATOM        6
            1   C2b C    28.8452  -18.0094
            2   C6a C    30.0625  -17.3129
            3   C2b C    27.6338  -17.3188
            4   O6a O    31.2796  -18.0034
            5   O6a O    30.0625  -15.9143
            6   X   Cl   26.4166  -18.0211
BOND        5
            1     1   2 1
            2     1   3 2
            3     2   4 1
            4     2   5 2
            5     3   6 1

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