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68 entries found, displaying 1 to 15.
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1-methyl-3-propyl-7H-xanthine
CHEBI:145517 CHEBI:145517 CHEBI:145517
Stars:
Tanimoto Score: 1.0
Formula: C9H12N4O2
Mass: 208.221
Charge: 0
enprofylline
CHEBI:126237 CHEBI:126237 CHEBI:126237
Stars:
Tanimoto Score: 1.0
Formula: C8H10N4O2
Mass: 194.19060
Charge: 0
3-isobutyl-1-methyl-7H-xanthine
CHEBI:34795 CHEBI:34795 CHEBI:34795
Stars:
Tanimoto Score: 0.97
Formula: C10H14N4O2
Mass: 222.24392
Charge: 0
3-isobutyl-1-methyl-9H-xanthine
CHEBI:43253 CHEBI:43253 CHEBI:43253
Stars:
Tanimoto Score: 0.97
Formula: C10H14N4O2
Mass: 222.24392
Charge: 0
3-methyl-9H-xanthine
CHEBI:62207 CHEBI:62207 CHEBI:62207
Stars:
Tanimoto Score: 0.94
Formula: C6H6N4O2
Mass: 166.13740
Charge: 0
3-methyl-7H-xanthine
CHEBI:62208 CHEBI:62208 CHEBI:62208
Stars:
Tanimoto Score: 0.94
Formula: C6H6N4O2
Mass: 166.13740
Charge: 0
1-methyl-7H-xanthine
CHEBI:68444 CHEBI:68444 CHEBI:68444
Stars:
Tanimoto Score: 0.94
Formula: C6H6N4O2
Mass: 166.13740
Charge: 0
theophylline
CHEBI:28177 CHEBI:28177 CHEBI:28177
Stars:
Tanimoto Score: 0.94
Formula: C7H8N4O2
Mass: 180.16418
Charge: 0
8-(methoxymethyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione
CHEBI:92940 CHEBI:92940 CHEBI:92940
Stars:
Tanimoto Score: 0.93
Formula: C12H18N4O3
Mass: 266.297
Charge: 0
7H-xanthine
CHEBI:48517 CHEBI:48517 CHEBI:48517
Stars:
Tanimoto Score: 0.92
Formula: C5H4N4O2
Mass: 152.11102
Charge: 0
9H-xanthine
CHEBI:17712 CHEBI:17712 CHEBI:17712
Stars:
Tanimoto Score: 0.92
Formula: C5H4N4O2
Mass: 152.11102
Charge: 0
2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-olate
CHEBI:46824 CHEBI:46824 CHEBI:46824
Stars:
Tanimoto Score: 0.9
Formula: C5H3N4O3
Mass: 167.10248
Charge: -1
8-phenyl-1,3-dipropyl-7H-purine-2,6-dione
CHEBI:107631 CHEBI:107631 CHEBI:107631
Stars:
Tanimoto Score: 0.89
Formula: C17H20N4O2
Mass: 312.367
Charge: 0
8-chlorotheophylline
CHEBI:59771 CHEBI:59771 CHEBI:59771
Stars:
Tanimoto Score: 0.89
Formula: C7H7ClN4O2
Mass: 214.60900
Charge: 0
8-chlorotheophylline(1−)
CHEBI:59778 CHEBI:59778 CHEBI:59778
Stars:
Tanimoto Score: 0.89
Formula: C7H6ClN4O2
Mass: 213.60100
Charge: -1
68 entries found, displaying 1 to 15.
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