KEGG   COMPOUND: C04628Help
Entry
C04628                      Compound                               

Name
Coenzyme B;
N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate;
N-(7-Mercaptoheptanoyl)threonine O3-phosphate;
HTP
Formula
C11H22NO6PS
Exact mass
327.0905
Mol weight
327.3342
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Methane metabolism
Metabolic pathways
Microbial metabolism in diverse environments
Enzyme
1.8.98.1        2.7.1.-         2.8.4.1
Brite
Compounds with biological roles [BR:br08001]
 Cofactors
  Others
   Coenzymes
    C04628  Coenzyme B
BRITE hierarchy
Other DBs
CAS: 
104302-77-4
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        20
            1   C1a C    17.4300  -23.1700
            2   C1c C    18.6200  -22.4700
            3   C1c C    19.8100  -23.1700
            4   N1b N    21.0700  -22.4700
            5   C5a C    22.2600  -23.1700
            6   C1b C    23.4500  -22.4700
            7   C1b C    24.7100  -23.1700
            8   C1b C    25.9000  -22.4700
            9   C1b C    27.0900  -23.1700
            10  C1b C    28.2800  -22.4700
            11  C1b C    29.5400  -23.1700
            12  S1a S    30.7300  -22.4700
            13  O5a O    22.2600  -24.5700
            14  C6a C    19.7928  -24.5699
            15  O6a O    18.5849  -25.2476
            16  O6a O    21.0092  -25.2924
            17  P1b P    18.6200  -21.0700
            18  O1c O    20.0200  -21.0700
            19  O1c O    17.2200  -21.0700
            20  O1c O    18.6200  -19.6700
BOND        19
            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   17  18 1
            18   17  19 1
            19   17  20 2

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