KEGG   COMPOUND: C04628Help
Entry
C04628                      Compound                               

Name
Coenzyme B;
N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate;
N-(7-Mercaptoheptanoyl)threonine O3-phosphate;
HTP;
CoB
Formula
C11H22NO7PS
Exact mass
343.0855
Mol weight
343.3336
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00680  Methane metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01200  Carbon metabolism
Module
M00356  Methanogenesis, methanol => methane
M00357  Methanogenesis, acetate => methane
M00563  Methanogenesis, methylamine/dimethylamine/trimethylamine => methane
M00567  Methanogenesis, CO2 => methane
Enzyme
1.3.4.1         1.8.7.3         1.8.98.1        1.8.98.4        
1.8.98.5        1.8.98.6        2.7.1.-         2.8.4.1
Brite
Compounds with biological roles [BR:br08001]
 Vitamins and Cofactors
  Cofactors
   Coenzymes
    C04628  Coenzyme B
BRITE hierarchy
Other DBs
CAS: 104302-77-4
PubChem: 7217
ChEBI: 28890
KNApSAcK: C00000760
PDB-CCD: TP7[PDBj]
3DMET: B01766
NIKKAJI: J372.864A
KCF data Show

ATOM        21
            1   C1a C    12.0604  -16.8971
            2   C1c C    13.2518  -16.1963
            3   C1c C    14.4432  -16.8971
            4   N1b N    15.7047  -16.1963
            5   C5a C    16.8960  -16.8971
            6   C1b C    18.0874  -16.1963
            7   C1b C    19.3489  -16.8971
            8   C1b C    20.5403  -16.1963
            9   C1b C    21.7317  -16.8971
            10  C1b C    22.9231  -16.1963
            11  C1b C    24.1846  -16.8971
            12  S1a S    25.3760  -16.1963
            13  O5a O    16.8960  -18.2987
            14  C6a C    14.4260  -18.2986
            15  O6a O    13.2166  -18.9771
            16  O6a O    15.6438  -19.0220
            17  O2b O    13.2522  -14.7702
            18  P1b P    13.2518  -13.3947
            19  O1c O    14.6534  -13.3947
            20  O1c O    11.8501  -13.3947
            21  O1c O    13.2518  -11.9930
BOND        20
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12    5  13 2
            13    3  14 1 #Down
            14   14  15 1
            15   14  16 2
            16    2  17 1 #Up
            17   18  19 1
            18   18  20 1
            19   18  21 2
            20   17  18 1

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