KEGG   COMPOUND: C16209
Entry
C16209                      Compound                               

Name
3-(2-Carboxyvinyl)naphthalene-2-carboxylic acid
Formula
C14H10O4
Exact mass
242.0579
Mol weight
242.2268
Structure
Reaction
Pathway
map00624  Polycyclic aromatic hydrocarbon degradation
Enzyme
1.13.11.-
Other DBs
PubChem: 47205517
ChEBI: 80380
NIKKAJI: J1.611.611D
KCF data

ATOM        18
            1   C8x C    22.1900  -20.1600
            2   C8x C    22.1900  -21.5600
            3   C8x C    23.4500  -22.2600
            4   C8x C    23.4500  -19.4600
            5   C8y C    24.6400  -20.1600
            6   C8y C    24.6400  -21.5600
            7   C8x C    25.8300  -22.2600
            8   C8x C    25.8300  -19.4600
            9   C8y C    27.0900  -20.1600
            10  C8y C    27.0900  -21.5600
            11  C6a C    28.2800  -19.4600
            12  O6a O    29.5400  -20.0900
            13  O6a O    28.2800  -18.0600
            14  C2b C    28.2800  -22.2600
            15  C2b C    29.4700  -21.5600
            16  C6a C    30.7300  -22.2600
            17  O6a O    31.9200  -21.4900
            18  O6a O    30.7300  -23.6600
BOND        19
            1     9   8 2
            2     8   5 1
            3     5   4 2
            4     4   1 1
            5     1   2 2
            6     2   3 1
            7     3   6 2
            8     9  10 1
            9     5   6 1
            10    6   7 1
            11    7  10 2
            12    9  11 1
            13   11  12 1
            14   11  13 2
            15   10  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 1
            19   16  18 2

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