KEGG   COMPOUND: C20465
Entry
C20465                      Compound                               

Name
Coumaryl acetate
Formula
C11H12O3
Exact mass
192.0786
Mol weight
192.2112
Structure
Reaction
Pathway
map00940  Phenylpropanoid biosynthesis
Enzyme
1.1.1.318       1.1.1.319       2.3.1.-
Other DBs
PubChem: 163312202
ChEBI: 73346
ChEMBL: CHEMBL111715
LinkDB
KCF data

ATOM        14
            1   C8x C    15.0406  -16.2325
            2   C8x C    16.2464  -15.5040
            3   C8y C    15.0640  -17.6392
            4   C8y C    17.4708  -16.1850
            5   C8x C    16.3064  -18.3162
            6   O1a O    13.8631  -18.3649
            7   C8x C    17.5041  -17.5856
            8   C2b C    18.6638  -15.4574
            9   C2b C    19.8952  -16.1274
            10  C1b C    21.0961  -15.4018
            11  O7a O    22.3058  -16.0682
            12  C7a C    23.4782  -15.3597
            13  C1a C    24.7105  -16.0384
            14  O6a O    23.4502  -13.9767
BOND        14
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 2
            5     3   6 1
            6     4   7 2
            7     4   8 1
            8     8   9 2
            9     9  10 1
            10    5   7 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   12  14 2

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