KEGG   COMPOUND: C00633
Entry
C00633                      Compound                               
Name
4-Hydroxybenzaldehyde;
p-Hydroxybenzaldehyde
Formula
C7H6O2
Exact mass
122.0368
Mol weight
122.12
Structure
Reaction
R01293 R01294 R01303 R02672 R02673 R02675 R02676 R06886
R12134 R13288 R13289 R13380
Pathway
map00363  Bisphenol degradation
map00623  Toluene degradation
map00627  Aminobenzoate degradation
map01061  Biosynthesis of phenylpropanoids
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.1.3.19        1.2.1.7         1.2.1.28        1.2.1.64        
1.2.1.96        1.3.-.-         1.13.11.94      1.14.99.-       
1.17.9.1        4.1.1.7         4.1.2.11        4.1.2.66
Other DBs
CAS: 123-08-0
PubChem: 3906
KNApSAcK: C00002657
PDB-CCD: HBA[PDBj]
NIKKAJI: J43.312H
LinkDB
KCF data

ATOM        9
            1   C8y C    28.0314  -18.4596
            2   C8x C    26.8219  -19.1573
            3   C8x C    29.2539  -19.1573
            4   C4a C    28.0250  -17.0706
            5   C8x C    26.8219  -20.5653
            6   C8x C    29.2539  -20.5653
            7   O4a O    29.2283  -16.3732
            8   C8y C    28.0314  -21.2759
            9   O1a O    28.0250  -22.6711
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 2
            7     5   8 1
            8     8   9 1
            9     6   8 2

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