KEGG   COMPOUND: C00212Help
Entry
C00212                      Compound                               

Name
Adenosine
Formula
C10H13N5O4
Exact mass
267.0968
Mol weight
267.2413
Structure
Mol fileKCF fileDB search
Remark
Same as: D00045
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
map04022  cGMP-PKG signaling pathway
map04024  cAMP signaling pathway
map04071  Sphingolipid signaling pathway
map04080  Neuroactive ligand-receptor interaction
map04270  Vascular smooth muscle contraction
map04923  Regulation of lipolysis in adipocytes
map04924  Renin secretion
map05012  Parkinson disease
map05032  Morphine addiction
map05034  Alcoholism
Enzyme
1.1.3.39        2.4.2.1         2.7.1.20        2.7.1.74        
2.7.1.114       3.1.3.5         3.1.3.6         3.2.2.1         
3.2.2.7         3.2.2.8         3.3.1.1         3.5.4.4         
3.13.1.8
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Ribonucleosides
    C00212  Adenosine (A)
Glycosides [BR:br08021]
 N-glycosides
  C00212  Adenosine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01E OTHER CARDIAC PREPARATIONS
    C01EB Other cardiac preparations
     C01EB10 Adenosine
      D00045  Adenosine (JAN/USP) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 7  Agents not mainly for therapeutic purpose
  79  Other agents not mainly for therapeutic purpose
   799  Miscellaneous
    7990  Miscellaneous
     D00045  Adenosine (JAN/USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adenosine
    ADORA
     D00045  Adenosine (JAN/USP) <JP/US>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00045
BRITE hierarchy
Other DBs
CAS: 58-61-7
PubChem: 3512
ChEBI: 16335
ChEMBL: CHEMBL477
KNApSAcK: C00007444
PDB-CCD: ADN[PDBj]
3DMET: B01189
NIKKAJI: J4.501B
KCF data Show

ATOM        19
            1   N4y N    21.8935  -16.5762
            2   C8y C    22.9578  -17.3132
            3   C1y C    20.6008  -16.9916
            4   C8x C    22.3672  -15.1784
            5   C8y C    24.1919  -16.4066
            6   N5x N    23.0923  -18.7344
            7   O2x O    19.4603  -16.1435
            8   C1y C    20.1739  -18.2432
            9   N5x N    23.8176  -15.1842
            10  C8y C    25.4437  -16.9565
            11  C8x C    24.4143  -19.3251
            12  C1y C    18.3607  -16.9331
            13  C1y C    18.7877  -18.2432
            14  O1a O    20.5832  -19.5767
            15  N5x N    25.6073  -18.4420
            16  N1a N    26.5490  -16.1376
            17  C1b C    17.0564  -16.5236
            18  O1a O    18.3431  -19.5709
            19  O1a O    15.9453  -17.3600
BOND        21
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19    5   9 1
            20   11  15 1
            21   12  13 1

» Japanese version

KEGG   COMPOUND: C00294Help
Entry
C00294                      Compound                               

Name
Inosine
Formula
C10H12N4O5
Exact mass
268.0808
Mol weight
268.2261
Structure
Mol fileKCF fileDB search
Remark
Same as: D00054
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
1.1.3.28        2.4.2.1         2.4.2.15        2.7.1.73        
3.1.3.5         3.1.3.99        3.2.2.1         3.2.2.2         
3.2.2.8         3.5.4.4
Brite
Glycosides [BR:br08021]
 N-glycosides
  C00294  Inosine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D06 ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
   D06B CHEMOTHERAPEUTICS FOR TOPICAL USE
    D06BB Antivirals
     D06BB05 Inosine
      D00054  Inosine (JAN/INN)
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AX Other antiinfectives and antiseptics
     G01AX02 Inosine
      D00054  Inosine (JAN/INN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01X OTHER OPHTHALMOLOGICALS
    S01XA Other ophthalmologicals
     S01XA10 Inosine
      D00054  Inosine (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 58-63-9
PubChem: 3588
ChEBI: 17596
ChEMBL: CHEMBL1556
KNApSAcK: C00019692
PDB-CCD: NOS[PDBj]
3DMET: B01208
NIKKAJI: J1.388I
KCF data Show

ATOM        19
            1   N4y N    26.2067  -17.2376
            2   C8y C    27.4680  -16.8872
            3   C1y C    24.6651  -17.8682
            4   C8x C    25.3658  -16.1865
            5   C8y C    27.4680  -15.4858
            6   N5x N    28.7293  -17.5879
            7   O2x O    23.4739  -16.9573
            8   C1y C    24.1746  -19.1295
            9   N5x N    26.2067  -15.0654
            10  C8y C    28.7293  -14.7851
            11  C8x C    29.9205  -16.8872
            12  C1y C    22.3528  -17.8682
            13  C1y C    22.7732  -19.1295
            14  O1a O    25.0155  -20.2506
            15  N4x N    29.9205  -15.4858
            16  O5x O    28.7293  -13.4537
            17  C1b C    21.0915  -17.4478
            18  O1a O    22.0024  -20.2506
            19  O1a O    19.9704  -18.3587
BOND        21
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 1
            15   10  16 2
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19    5   9 1
            20   11  15 1
            21   12  13 1

» Japanese version

KEGG   COMPOUND: C00299Help
Entry
C00299                      Compound                               

Name
Uridine
Formula
C9H12N2O6
Exact mass
244.0695
Mol weight
244.2014
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00240  Pyrimidine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
1.14.11.3       2.4.2.2         2.4.2.3         2.7.1.48        
2.7.1.213       3.1.3.5         3.1.3.6         3.2.2.3         
3.5.4.5
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Ribonucleosides
    C00299  Uridine (U)
BRITE hierarchy
Other DBs
CAS: 58-96-8
PubChem: 3593
ChEBI: 16704
ChEMBL: CHEMBL100259
KNApSAcK: C00019674
PDB-CCD: URI[PDBj]
3DMET: B01210
NIKKAJI: J4.593D
KCF data Show

ATOM        17
            1   C1y C    23.5730  -16.8351
            2   N4y N    25.1226  -16.3495
            3   O2x O    22.4835  -16.0311
            4   C1y C    23.1594  -18.2044
            5   C8y C    26.3387  -17.0494
            6   C8x C    25.1311  -14.9553
            7   C1y C    21.3414  -16.8643
            8   C1y C    21.7610  -18.2044
            9   O1a O    23.9809  -19.3289
            10  N4x N    27.5623  -16.3496
            11  O5x O    26.3486  -18.4457
            12  C8x C    26.3352  -14.2474
            13  C1b C    20.0130  -16.4331
            14  O1a O    20.9335  -19.3230
            15  C8y C    27.5570  -14.9464
            16  O1a O    18.8885  -17.2663
            17  O5x O    28.7761  -14.2533
BOND        18
            1     1   2 1 #Up
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    7  13 1 #Up
            13    8  14 1 #Down
            14   10  15 1
            15   13  16 1
            16   15  17 2
            17    7   8 1
            18   12  15 1

» Japanese version

KEGG   COMPOUND: C00330Help
Entry
C00330                      Compound                               

Name
Deoxyguanosine;
2'-Deoxyguanosine
Formula
C10H13N5O4
Exact mass
267.0968
Mol weight
267.2413
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.2.1         2.4.2.4         2.7.1.113       3.1.3.5         
3.1.3.89        3.1.5.1
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Deoxyribonucleosides
    C00330  Deoxyguanosine (dG)
BRITE hierarchy
Other DBs
CAS: 961-07-9
PubChem: 3624
ChEBI: 17172
ChEMBL: CHEMBL68908
PDB-CCD: GNG[PDBj]
3DMET: B01219
NIKKAJI: J13.863K
KCF data Show

ATOM        19
            1   N4y N    25.1183  -21.8405
            2   C8y C    26.1851  -22.5926
            3   C1y C    23.8416  -22.2486
            4   C8x C    25.6022  -20.4415
            5   C8y C    27.4268  -21.6831
            6   N5x N    26.3191  -23.9975
            7   O2x O    22.6932  -21.4092
            8   C1x C    23.3985  -23.4962
            9   N5x N    27.0595  -20.4415
            10  C8y C    28.6919  -22.2252
            11  C8y C    27.6425  -24.5863
            12  C1y C    21.5914  -22.2019
            13  C1y C    22.0169  -23.4962
            14  N4x N    28.8550  -23.7118
            15  O5x O    29.7994  -21.4208
            16  N1a N    27.7766  -25.9562
            17  C1b C    20.2913  -21.7823
            18  O1a O    21.2474  -24.6680
            19  O1a O    19.2536  -22.7150
BOND        21
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13   10  14 1
            14   10  15 2
            15   11  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19    5   9 1
            20   11  14 1
            21   12  13 1

» Japanese version

KEGG   COMPOUND: C00387Help
Entry
C00387                      Compound                               

Name
Guanosine
Formula
C10H13N5O5
Exact mass
283.0917
Mol weight
283.2407
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.2.1         2.4.2.15        2.7.1.73        3.1.3.5         
3.1.3.6         3.2.2.1         3.2.2.8         3.5.4.15
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Ribonucleosides
    C00387  Guanosine (G)
BRITE hierarchy
Other DBs
CAS: 118-00-3
PubChem: 3677
ChEBI: 16750
ChEMBL: CHEMBL375655
KNApSAcK: C00019679
PDB-CCD: GMP[PDBj]
3DMET: B01233
NIKKAJI: J10.076E
KCF data Show

ATOM        20
            1   C8y C    28.1103  -19.2792
            2   N4y N    27.0433  -18.5271
            3   C8y C    29.3522  -18.3697
            4   N5x N    28.2444  -20.6844
            5   C1y C    25.7605  -18.9353
            6   C8x C    27.5273  -17.1278
            7   N5x N    28.9791  -17.1278
            8   C8y C    30.6116  -18.9120
            9   C8y C    29.5680  -21.2733
            10  O2x O    24.6178  -18.0956
            11  C1y C    25.3232  -20.1888
            12  N4x N    30.7807  -20.3988
            13  O5x O    31.7252  -18.1073
            14  N1a N    29.7021  -22.6436
            15  C1y C    23.5156  -18.8886
            16  C1y C    23.9355  -20.1888
            17  O1a O    26.2503  -21.2266
            18  C1b C    22.2096  -18.4688
            19  O1a O    23.1717  -21.3550
            20  O1a O    21.1776  -19.4017
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 2
            9     5  10 1
            10    5  11 1
            11    8  12 1
            12    8  13 2
            13    9  14 1
            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

» Japanese version

KEGG   COMPOUND: C00475Help
Entry
C00475                      Compound                               

Name
Cytidine
Formula
C9H13N3O5
Exact mass
243.0855
Mol weight
243.2166
Structure
Mol fileKCF fileDB search
Remark
Same as: D07769
Reaction
Pathway
map00240  Pyrimidine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.2.2         2.7.1.48        2.7.1.213       3.1.3.5         
3.1.3.6         3.1.3.91        3.2.2.8         3.5.4.5
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Ribonucleosides
    C00475  Cytidine (C)
BRITE hierarchy
Other DBs
CAS: 65-46-3
PubChem: 3758
ChEBI: 17562
ChEMBL: CHEMBL2028065 CHEMBL95606
KNApSAcK: C00042440
PDB-CCD: CTN[PDBj]
3DMET: B01256
NIKKAJI: J4.837B
KCF data Show

ATOM        17
            1   C1y C    25.8246  -16.1700
            2   N4y N    27.1592  -15.7446
            3   O2x O    24.6821  -15.3075
            4   C1y C    25.4106  -17.4641
            5   C8y C    28.1676  -16.6947
            6   C8x C    27.4739  -14.3983
            7   C1y C    23.5572  -16.1467
            8   C1y C    23.9943  -17.4641
            9   O1a O    25.8362  -18.8221
            10  N5x N    29.5082  -16.2983
            11  O5x O    27.8587  -18.0644
            12  C8x C    28.8088  -13.9843
            13  C1b C    22.2283  -15.7213
            14  O1a O    23.5629  -18.8280
            15  C8y C    29.8113  -14.9461
            16  O1a O    21.1965  -16.6597
            17  N1a N    31.1693  -14.5497
BOND        18
            1     1   2 1 #Up
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    7  13 1 #Up
            13    8  14 1 #Down
            14   10  15 2
            15   13  16 1
            16   15  17 1
            17    7   8 1
            18   12  15 1

» Japanese version

KEGG   COMPOUND: C00526Help
Entry
C00526                      Compound                               

Name
Deoxyuridine;
2-Deoxyuridine;
2'-Deoxyuridine
Formula
C9H12N2O5
Exact mass
228.0746
Mol weight
228.202
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00240  Pyrimidine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
1.14.11.3       1.14.11.10      2.4.2.1         2.4.2.2         
2.4.2.3         2.4.2.4         2.7.1.21        3.1.3.5         
3.1.3.89        3.5.4.5
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Deoxyribonucleosides
    C00526  Deoxyuridine (dU)
BRITE hierarchy
Other DBs
CAS: 951-78-0
PubChem: 3809
ChEBI: 16450
ChEMBL: CHEMBL353955
KNApSAcK: C00019697
PDB-CCD: DUR[PDBj]
3DMET: B01281
NIKKAJI: J7.186B
KCF data Show

ATOM        16
            1   C1y C    25.8014  -16.2807
            2   N4y N    27.1414  -15.8321
            3   O2x O    24.7119  -15.4709
            4   C1x C    25.3935  -17.6383
            5   C8y C    28.1902  -16.7643
            6   C8x C    27.4327  -14.4688
            7   C1y C    23.5757  -16.3040
            8   C1y C    23.9952  -17.6383
            9   N4x N    29.5243  -16.3274
            10  O5x O    27.9106  -18.1393
            11  C8x C    28.7554  -14.0261
            12  C1b C    22.2416  -15.8788
            13  O1a O    23.1621  -18.7687
            14  C8y C    29.8098  -14.9583
            15  O1a O    21.2102  -16.8226
            16  O5x O    31.1382  -14.5213
BOND        17
            1     1   2 1 #Up
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    7  12 1 #Up
            12    8  13 1 #Down
            13    9  14 1
            14   12  15 1
            15   14  16 2
            16    7   8 1
            17   11  14 1

» Japanese version

KEGG   COMPOUND: C00559Help
Entry
C00559                      Compound                               

Name
Deoxyadenosine;
2'-Deoxyadenosine
Formula
C10H13N5O3
Exact mass
251.1018
Mol weight
251.2419
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.2.1         2.7.1.76        3.1.3.5         3.1.3.89        
3.5.4.4
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Deoxyribonucleosides
    C00559  Deoxyadenosine (dA)
BRITE hierarchy
Other DBs
CAS: 958-09-8
PubChem: 3839
ChEBI: 17256
ChEMBL: CHEMBL449329
KNApSAcK: C00019281
PDB-CCD: 3D1[PDBj]
3DMET: B01287
NIKKAJI: J80.042B
KCF data Show

ATOM        18
            1   N4y N    29.3189  -22.6435
            2   C8y C    30.3830  -23.3802
            3   C1y C    28.0327  -23.0586
            4   C8x C    29.7984  -21.2463
            5   C8y C    31.6223  -22.4740
            6   N5x N    30.5174  -24.8008
            7   O2x O    26.8985  -22.2108
            8   C1x C    27.6001  -24.3098
            9   N5x N    31.2483  -21.2521
            10  C8y C    32.8793  -23.0235
            11  C8x C    31.8446  -25.3913
            12  C1y C    25.7936  -23.0001
            13  C1y C    26.2146  -24.3098
            14  N5x N    33.0372  -24.5085
            15  N1a N    33.9842  -22.2051
            16  C1b C    24.4898  -22.5910
            17  O1a O    25.7761  -25.6251
            18  O1a O    23.4608  -23.5380
BOND        20
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13   10  14 2
            14   10  15 1
            15   12  16 1 #Up
            16   13  17 1 #Down
            17   16  18 1
            18    5   9 1
            19   11  14 1
            20   12  13 1

» Japanese version

KEGG   COMPOUND: C00881Help
Entry
C00881                      Compound                               

Name
Deoxycytidine;
2'-Deoxycytidine
Formula
C9H13N3O4
Exact mass
227.0906
Mol weight
227.2172
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00240  Pyrimidine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.7.1.74        2.7.1.213       3.1.3.5         3.1.3.89        
3.5.4.5
Brite
Compounds with biological roles [BR:br08001]
 Nucleic acids
  Nucleosides
   Deoxyribonucleosides
    C00881  Deoxycytidine (dC)
BRITE hierarchy
Other DBs
CAS: 951-77-9
PubChem: 4137
ChEBI: 15698
ChEMBL: CHEMBL66115
PDB-CCD: DCZ[PDBj]
3DMET: B01347
NIKKAJI: J14.406A
KCF data Show

ATOM        16
            1   C1y C    27.2008  -18.3574
            2   N4y N    28.5309  -17.9316
            3   O2x O    26.0574  -17.4941
            4   C1x C    26.7867  -19.6526
            5   C8y C    29.5459  -18.8825
            6   C8x C    28.8459  -16.5841
            7   C1y C    24.9315  -18.3342
            8   C1y C    25.3690  -19.6526
            9   N5x N    30.8876  -18.4858
            10  O5x O    29.2367  -20.2534
            11  C8x C    30.1819  -16.1698
            12  C1b C    23.5956  -17.9083
            13  O1a O    24.9373  -21.0177
            14  C8y C    31.1910  -17.1324
            15  O1a O    22.5631  -18.8475
            16  N1a N    32.5444  -16.7357
BOND        17
            1     1   2 1 #Up
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    7  12 1 #Up
            12    8  13 1 #Down
            13    9  14 2
            14   12  15 1
            15   14  16 1
            16    7   8 1
            17   11  14 1

» Japanese version

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
map02010  ABC transporters
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
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

» Japanese version

KEGG   COMPOUND: C05512Help
Entry
C05512                      Compound                               

Name
Deoxyinosine
Formula
C10H12N4O4
Exact mass
252.0859
Mol weight
252.2267
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.2.1         2.4.2.4         3.5.4.4
Other DBs
CAS: 890-38-0
PubChem: 7859
ChEBI: 28997
ChEMBL: CHEMBL1229971
PDB-CCD: 2ND[PDBj]
3DMET: B01869
NIKKAJI: J128.131C
KCF data Show

ATOM        18
            1   N4y N    27.1019  -19.8619
            2   C8y C    28.1702  -20.5975
            3   C1y C    25.8175  -20.2765
            4   C8x C    27.5807  -18.4666
            5   C8y C    29.4021  -19.6926
            6   N5x N    28.3046  -22.0163
            7   O2x O    24.6791  -19.4241
            8   C1x C    25.3914  -21.5258
            9   N5x N    29.0284  -18.4726
            10  C8y C    30.6516  -20.2415
            11  C8x C    29.6240  -22.6058
            12  C1y C    23.5815  -20.2181
            13  C1y C    24.0076  -21.5258
            14  N4x N    30.8149  -21.7243
            15  O5x O    31.7549  -19.4183
            16  C1b C    22.2562  -19.7803
            17  O1a O    23.1904  -22.6526
            18  O1a O    21.2171  -20.7144
BOND        20
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13   10  14 1
            14   10  15 2
            15   12  16 1 #Up
            16   13  17 1 #Down
            17   16  18 1
            18    5   9 1
            19   11  14 1
            20   12  13 1

» Japanese version

DBGET integrated database retrieval system