KEGG   COMPOUND: C00099
Entry
C00099                      Compound                               
Name
beta-Alanine;
3-Aminopropionic acid;
3-Aminopropanoate
Formula
C3H7NO2
Exact mass
89.0477
Mol weight
89.09
Structure
Remark
Same as: D07561
Reaction
R00489 R00904 R00905 R00906 R00907 R00908 R00909 R00910
R00911 R00912 R00913 R00914 R00915 R00916 R00917 R01164
R01166 R02473 R02474 R02741 R03286 R03288 R03935 R09379
R09648 R10821
Pathway
map00240  Pyrimidine metabolism
map00410  beta-Alanine metabolism
map00640  Propanoate metabolism
map00770  Pantothenate and CoA biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01240  Biosynthesis of cofactors
map04080  Neuroactive ligand-receptor interaction
map04974  Protein digestion and absorption
Module
M00046  Pyrimidine degradation, uracil => beta-alanine, thymine => 3-aminoisobutanoate
M00119  Pantothenate biosynthesis, valine/L-aspartate => pantothenate
M00913  Pantothenate biosynthesis, 2-oxoisovalerate/spermine => pantothenate
Enzyme
1.2.1.3         1.2.1.5         1.2.1.19        1.5.1.26        
2.6.1.18        2.6.1.19        2.6.1.55        2.6.1.120       
2.8.3.-         3.4.13.4        3.4.13.5        3.4.13.18       
3.4.13.20       3.5.1.6         3.5.1.21        3.5.1.22        
3.5.1.100       3.5.3.17        4.1.1.11        4.1.1.15        
6.3.2.1         6.3.2.11        6.3.2.23        6.3.2.36        
6.3.2.44
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Other amino acids
    C00099  beta-Alanine
  Amines
   Biogenic amines
    C00099  beta-Alanine
Other DBs
CAS: 107-95-9
PubChem: 3399
ChEBI: 16958
KNApSAcK: C00001333
PDB-CCD: BAL[PDBj]
J-GLOBAL: J4.070C
LinkDB
KCF data

ATOM        6
            1   C1b C    25.6778  -16.8919
            2   C6a C    24.4732  -16.1936
            3   C1b C    26.8940  -16.1936
            4   O6a O    23.2571  -16.8978
            5   O6a O    24.4732  -14.7912
            6   N1a N    28.1045  -16.8919
BOND        5
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1

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