KEGG   COMPOUND: C01762Help
Entry
C01762                      Compound                               

Name
Xanthosine
Formula
C10H12N4O6
Exact mass
284.0757
Mol weight
284.2255
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map00232  Caffeine metabolism
map01065  Biosynthesis of alkaloids derived from histidine and purine
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
2.1.1.158       2.4.2.1         2.4.2.-         3.1.3.5         
3.2.2.1         3.5.4.15
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Others
   Purine alkaloids
    C01762  Xanthosine
BRITE hierarchy
Other DBs
CAS: 146-80-5
PubChem: 4895
ChEBI: 18107
ChEMBL: CHEMBL402439
KNApSAcK: C00007222
PDB-CCD: 4UO[PDBj]
3DMET: B01495
NIKKAJI: J9.367J
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8y C    19.5636  -12.2457
            2   N4y N    20.8454  -12.6584
            3   C8y C    19.5636  -10.8896
            4   N4x N    18.3865  -12.9296
            5   C1y C    20.5066  -15.3271
            6   C8x C    21.6407  -11.5738
            7   N5x N    20.8517  -10.4767
            8   C8y C    18.3865  -10.2179
            9   C8y C    17.2278  -12.2457
            10  O2x O    19.4033  -14.5258
            11  C1y C    20.0997  -16.5843
            12  N4x N    17.2278  -10.8896
            13  O5x O    18.3802   -9.0212
            14  O5x O    16.0630  -12.9112
            15  C1y C    18.3309  -15.3087
            16  C1y C    18.7624  -16.5843
            17  O1a O    20.9010  -17.6629
            18  C1b C    17.0491  -14.9019
            19  O1a O    17.9797  -17.6752
            20  O1a O    16.0630  -15.8016
BOND        22
            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

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