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TMDB ID Entry Name
CAS Number
Compound Formula
Molecular Weight
2D Structure
TMDB00331 Theobromine
83-67-0
C7H8N4O2
180.16402
TMDB00332 Theophylline
58-55-9
C7H8N4O2
180.16402
TMDB00333 Temurin
2309-49-1
C9H12N4O3
224.21658
TMDB00334 Liberine; 7-Me
51168-26-4
C9H12N4O3
224.21658
TMDB00335 Xanthine
69-89-6
C5H4N4O2
152.11086
TMDB00336 Hypoxanthine
68-94-0
C5H4N4O
136.11146
TMDB00337 Paraxanthine
611-59-6
C7H8N4O2
180.16402
TMDB00339 Adenine
73-24-5
C5H5N5
135.1267
TMDB00340 Guanine
73-40-5
C5H5N5O
151.1261
TMDB00354 1,3,9-Trimethyluric acid
7464-93-9
C8H10N4O3
210.19
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