KEGG   COMPOUND: C00250Help
Entry
C00250                      Compound                               

Name
Pyridoxal
Formula
C8H9NO3
Exact mass
167.0582
Mol weight
167.162
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00750  Vitamin B6 metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map04977  Vitamin digestion and absorption
Enzyme
1.1.1.65        1.1.1.107       1.1.3.12        1.2.3.1         
1.2.3.8         1.4.3.5         2.6.1.30        2.6.1.31        
2.6.1.54        2.7.1.35        3.1.3.74
Brite
Compounds with biological roles [BR:br08001]
 Vitamins and Cofactors
  Vitamins
   Water-soluble vitamins
    C00250  Pyridoxal (Vitamin B6)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Pyridoxine hydrochloride
    C00250  Pyridoxal
BRITE hierarchy
Other DBs
CAS: 66-72-8
PubChem: 3549
ChEBI: 17310
ChEMBL: CHEMBL102970
KNApSAcK: C00007509
PDB-CCD: PXL[PDBj]
3DMET: B00072
NIKKAJI: J2.361B
LinkDB All DBs
KCF data Show

ATOM        12
            1   C8y C    25.0720  -15.4534
            2   C8y C    26.2781  -16.1643
            3   C8y C    23.8542  -16.1643
            4   C4a C    25.0720  -14.0607
            5   C8x C    26.2781  -17.5741
            6   C1b C    27.4957  -15.4767
            7   C8y C    23.8542  -17.5741
            8   O1a O    22.6422  -15.4708
            9   O4a O    26.2838  -13.3675
            10  N5x N    25.0720  -18.2733
            11  O1a O    28.6960  -16.1757
            12  C1a C    22.6422  -18.2733
BOND        12
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    6  11 1
            11    7  12 1
            12    7  10 1

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