KEGG   COMPOUND: C18253Help
Entry
C18253                      Compound                               

Name
Phenanthrene-4-carboxylate;
4-Phenanthroic acid
Formula
C15H10O2
Exact mass
222.0681
Mol weight
222.2387
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00624  Polycyclic aromatic hydrocarbon degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.14.12.-       4.1.1.-
Other DBs
CAS: 42156-92-3
PubChem: 103061435
ChEBI: 81604
KCF data Show

ATOM        17
            1   C8x C    23.5163  -18.6284
            2   C8x C    23.5163  -20.0448
            3   C8x C    24.7429  -20.7530
            4   C8x C    25.9696  -20.0448
            5   C8y C    25.9696  -18.6284
            6   C8y C    24.7429  -17.9202
            7   C8y C    27.1962  -17.9202
            8   C8y C    27.1962  -16.5038
            9   C8x C    25.9696  -15.7956
            10  C8x C    24.7429  -16.5038
            11  C8y C    28.4228  -18.6284
            12  C8x C    29.6495  -17.9202
            13  C8x C    29.6495  -16.5038
            14  C8x C    28.4228  -15.7956
            15  C6a C    28.4328  -19.8417
            16  O6a O    29.6734  -20.5445
            17  O6a O    27.3815  -20.5433
BOND        19
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 2
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    6  10 2
            12    7  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    8  14 1
            17   11  15 1
            18   15  16 2
            19   15  17 1

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