KEGG   COMPOUND: C14418
Entry
C14418                      Compound                               
Name
3-Nitrophenol;
m-Hydroxynitrobenzene
Formula
C6H5NO3
Exact mass
139.0269
Mol weight
139.1088
Structure
Reaction
R09288
Pathway
map00627  Aminobenzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.7.1.-
Other DBs
CAS: 554-84-7
PubChem: 17395418
ChEBI: 34346
PDB-CCD: ZCQ[PDBj]
NIKKAJI: J2.655G
LinkDB
KCF data

ATOM        10
            1   C8x C    26.4571  -16.2375
            2   C8x C    26.4571  -17.6373
            3   C8x C    27.6694  -18.3372
            4   C8y C    28.8817  -17.6373
            5   C8x C    28.8817  -16.2375
            6   C8y C    27.6694  -15.5376
            7   O1a O    27.6694  -14.1380
            8   N2b N    30.1126  -18.3482 #+
            9   O3a O    31.6676  -17.5126 #-
            10  O3a O    30.1123  -19.7369
BOND        10
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     4   8 1
            9     8   9 1
            10    8  10 2

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