KEGG   COMPOUND: C09814Help
Entry
C09814                      Compound                               

Name
Benzonitrile;
Phenyl cyanide;
Cyanobenzene
Formula
C7H5N
Exact mass
103.0422
Mol weight
103.1213
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00627  Aminobenzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
3.5.5.1         4.2.1.84
Other DBs
CAS: 100-47-0
PubChem: 12002
ChEBI: 27991
ChEMBL: CHEMBL15819
3DMET: B01115
NIKKAJI: J3.590D
LinkDB All DBs
KCF data Show

ATOM        8
            1   C8y C    28.8277  -16.6052
            2   C8x C    27.6158  -17.3078
            3   C8x C    30.0397  -17.3078
            4   C3b C    28.8336  -15.2058
            5   C8x C    27.6158  -18.7073
            6   C8x C    30.0397  -18.7073
            7   N3a N    30.0457  -14.5090
            8   C8x C    28.8277  -19.4099
BOND        8
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 3
            7     5   8 1
            8     6   8 2

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