KEGG   COMPOUND: C02666Help
Entry
C02666                      Compound                               

Name
Coniferyl aldehyde;
Coniferaldehyde;
4-Hydroxy-3-methoxycinnamaldehyde;
Ferulaldehyde
Formula
C10H10O3
Exact mass
178.063
Mol weight
178.1846
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00940  Phenylpropanoid biosynthesis
map01061  Biosynthesis of phenylpropanoids
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00039  Monolignol biosynthesis, phenylalanine/tyrosine => monolignol
Enzyme
1.1.1.194       1.1.1.195       1.2.1.44        1.2.1.68        
1.14.13.-       2.1.1.68
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Monolignols
   Coniferyl alcohol derivatives
    C02666  Coniferyl aldehyde
BRITE hierarchy
Other DBs
CAS: 458-36-6
PubChem: 5637
ChEBI: 16547
ChEMBL: CHEMBL242529
KNApSAcK: C00002728 C00035949
PDB-CCD: CIY[PDBj]
3DMET: B00482
NIKKAJI: J196.170E
KCF data Show

ATOM        13
            1   C8y C    34.6088  -18.6544
            2   C8x C    34.6088  -20.0566
            3   C8x C    35.8232  -20.7578
            4   C8y C    37.0376  -20.0566
            5   C8y C    37.0376  -18.6544
            6   C8x C    35.8232  -17.9532
            7   O1a O    38.2707  -20.7688
            8   O2a O    38.2707  -17.9422
            9   C1a C    38.2707  -16.5399
            10  C2b C    33.3944  -17.9532
            11  C2b C    32.1970  -18.6448
            12  C4a C    31.0077  -17.9581
            13  O4a O    31.0077  -16.5581
BOND        13
            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     4   7 1
            8     5   8 1
            9     8   9 1
            10    1  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2

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