KEGG   COMPOUND: C00178
Entry
C00178                      Compound                               
Name
Thymine;
5-Methyluracil
Formula
C5H6N2O2
Exact mass
126.0429
Mol weight
126.1133
Structure
Reaction
Pathway
map00240  Pyrimidine metabolism
map01100  Metabolic pathways
map01232  Nucleotide metabolism
Module
M00046  Pyrimidine degradation, uracil => beta-alanine, thymine => 3-aminoisobutanoate
Enzyme
1.3.1.1         1.3.1.2         1.14.11.6       1.14.99.46      
1.17.99.4       2.4.2.2         2.4.2.4         2.4.2.6         
3.2.2.10        3.5.4.1
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Bases
   Pyrimidines
    C00178  Thymine (Thy)
Other DBs
CAS: 65-71-4
PubChem: 3478
ChEBI: 17821
KNApSAcK: C00001511
PDB-CCD: TDR[PDBj]
3DMET: B00051
NIKKAJI: J2.357D
KCF data

ATOM        9
            1   C8y C    25.6258  -15.1488
            2   C8y C    26.8279  -15.8491
            3   N4x N    24.4121  -15.8432
            4   O5x O    25.6258  -13.7483
            5   C8x C    26.8279  -17.2554
            6   C1a C    28.0416  -15.1546
            7   C8y C    24.4121  -17.2496
            8   N4x N    25.6142  -17.9556
            9   O5x O    23.1924  -17.9440
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     5   8 1
            8     7   9 2
            9     7   8 1

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