KEGG   COMPOUND: C16352Help
Entry
C16352                      Compound                               

Name
7-Methylxanthosine
Formula
C11H15N4O6
Exact mass
299.0992
Mol weight
299.26
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00232  Caffeine metabolism
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
2.1.1.158       3.2.2.25
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Others
   Purine alkaloids
    C16352  7-Methylxanthosine
BRITE hierarchy
Other DBs
PubChem: 47205660
ChEBI: 49310
NIKKAJI: J466.510D
KCF data Show

ATOM        21
            1   C8y C    30.0117  -23.6700
            2   N4y N    31.2943  -24.0829
            3   C8y C    30.0117  -22.3131
            4   N4x N    28.8339  -24.3543
            5   C1y C    30.9553  -26.7533
            6   C8x C    32.0901  -22.9977
            7   N5y N    31.3006  -21.8999 #+
            8   C8y C    28.8339  -21.6410
            9   C8y C    27.6745  -23.6700
            10  O2x O    29.8513  -25.9515
            11  C1y C    30.5481  -28.0112
            12  N4x N    27.6745  -22.3131
            13  O5x O    28.8276  -20.4435
            14  O5x O    26.5090  -24.3359
            15  C1y C    28.7783  -26.7348
            16  C1y C    29.2100  -28.0112
            17  O1a O    31.3499  -29.0905
            18  C1b C    27.4957  -26.3278
            19  O1a O    28.4269  -29.1028
            20  O1a O    26.5090  -27.2280
            21  C1a C    31.7334  -20.5882
BOND        23
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     5   2 1 #Up
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    8  12 1
            12    8  13 2
            13    9  14 2
            14   10  15 1
            15   11  16 1
            16   11  17 1 #Down
            17   15  18 1 #Up
            18   16  19 1 #Down
            19   18  20 1
            20    6   7 2
            21    9  12 1
            22   15  16 1
            23    7  21 1

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