KEGG   COMPOUND: C01081Help
Entry
C01081                      Compound                               

Name
Thiamin monophosphate;
Thiamine monophosphate;
Thiamin phosphate;
Thiamine phosphate;
TMP
Formula
C12H18N4O4PS
Exact mass
345.0786
Mol weight
345.3345
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Thiamine metabolism
Metabolic pathways
Module
M00127  
Thiamine biosynthesis, AIR => thiamine-P/thiamine-2P
Enzyme
2.5.1.3         2.7.1.89        2.7.4.16        3.1.3.-         
3.6.1.15
Other DBs
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   N5y N    20.9300  -18.6200 #+
            2   C1b C    19.6700  -17.9200
            3   C8y C    22.0500  -17.8500
            4   C8x C    21.3500  -20.0200
            5   C8y C    18.4800  -18.6200
            6   C8y C    23.1700  -18.6200
            7   C1a C    22.0500  -16.5900
            8   S2x S    22.7500  -20.0200
            9   C8y C    18.4800  -20.0900
            10  C8x C    17.2900  -17.9200
            11  N5x N    17.2900  -20.7900
            12  N1a N    19.6700  -20.7900
            13  N5x N    16.0300  -18.6200
            14  C8y C    16.0300  -20.0900
            15  C1a C    14.8400  -20.7200
            16  C1b C    24.3600  -17.9200
            17  C1b C    25.6200  -18.6200
            18  O2b O    26.8100  -17.9200
            19  P1b P    28.2100  -17.9200
            20  O1c O    29.6800  -17.9200
            21  O1c O    28.2100  -16.5200
            22  O1c O    28.2100  -19.3200
BOND        23
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 2
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    9  11 2
            11    9  12 1
            12   10  13 1
            13   11  14 1
            14   14  15 1
            15    6   8 1
            16   13  14 2
            17    6  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   19  21 2
            23   19  22 1

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