KEGG   COMPOUND: C00755Help
Entry
C00755                      Compound                               

Name
4-Hydroxy-3-methoxy-benzaldehyde;
Vanillin;
Vanillaldehyde;
4-Hydroxy-3-methoxybenzaldehyde
Formula
C8H8O3
Exact mass
152.0473
Mol weight
152.1473
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Phenylalanine metabolism
Aminobenzoate degradation
Biosynthesis of phenylpropanoids
Biosynthesis of alkaloids derived from shikimate pathway
Metabolic pathways
Biosynthesis of secondary metabolites
Microbial metabolism in diverse environments
Module
M00350  
Capsaicin biosynthesis, L-Phenylalanine => Capsaicin
Enzyme
1.1.3.38        1.2.1.67        1.2.3.9         1.13.11.43      
4.1.2.41
Brite
Pharmaceutical additives [BR:br08316]
 Favoring agent, Fragrance
  D00091  [107548] Vanillin
 Refresher
  D00091  [107548] Vanillin
BRITE hierarchy
Other DBs
CAS: 
121-33-5
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        11
            1   C8y C    25.4479  -19.7481
            2   C8x C    25.4479  -18.3491
            3   C8y C    24.2422  -20.4445
            4   O2a O    26.6595  -20.4445
            5   C8y C    24.2422  -17.6467
            6   C8x C    23.0249  -19.7481
            7   O1a O    24.2422  -21.8493
            8   C8x C    23.0249  -18.3491
            9   C4a C    24.2422  -16.2478
            10  O4a O    23.0306  -15.5455
            11  C1a C    27.8804  -19.7365
BOND        11
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 1
            7     5   8 1
            8     5   9 1
            9     9  10 2
            10    6   8 2
            11    4  11 1

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