KEGG   COMPOUND: C14097
Entry
C14097                      Compound                               
Name
2-Hydroxyisophthalic acid;
2-Hydroxy-1,3-benzenedicarboxylic acid
Formula
C8H6O5
Exact mass
182.0215
Mol weight
182.1302
Structure
Reaction
R06924 R06925
Pathway
map00626  Naphthalene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.2.3.-         4.1.1.-
Other DBs
CAS: 606-19-9
PubChem: 854333
ChEBI: 19643
NIKKAJI: J94.854C
LinkDB
KCF data

ATOM        13
            1   C8x C    23.3669  -19.5505
            2   C8x C    24.5614  -20.2814
            3   C8x C    25.8606  -19.5373
            4   C8y C    23.4016  -18.1455
            5   C8y C    24.6332  -17.4811
            6   C8y C    25.8246  -18.2170
            7   O1a O    24.6724  -16.0786
            8   C6a C    22.2080  -17.4130
            9   O6a O    22.1789  -16.0142
            10  O6a O    20.9793  -18.0832
            11  C6a C    27.0525  -17.5457
            12  O6a O    27.0223  -16.1468
            13  O6a O    28.2468  -18.2771
BOND        13
            1     5   6 1
            2     7   5 1
            3     3   6 2
            4     4   8 1
            5     5   4 2
            6     8   9 2
            7     4   1 1
            8     8  10 1
            9     6  11 1
            10    1   2 2
            11   11  12 2
            12    2   3 1
            13   11  13 1

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