Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0I0DS
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| Former ID |
DNAP001596
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| Drug Name |
Theobromine
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| Synonyms |
theobromine; 83-67-0; 3,7-Dimethylxanthine; Diurobromine; Teobromin; Theostene; Theosalvose; Santheose; Thesodate; Thesal; 3,7-dimethylpurine-2,6-dione; 3,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione; Theobromin; Xanthine, 3,7-dimethyl-; 3,7-Dihydro-3,7-dimethyl-1H-purine-2,6-dione; 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-; SC 15090; 2,6-Dihydroxy-3,7-dimethylpurine; Theobromine (natural); UNII-OBD445WZ5P; NSC 5039; 7-Dimethylxanthine; 2,6-Dihydroxy-3,7-dimethyl-purine; BRN 0016464; FEMA No. 3591; CCRIS 2350; HSDB 7332
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| Drug Type |
Small molecular drug
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| Indication | Asthma [ICD-11: CA23; ICD-10: J45, J45.8; ICD-9: 493] | Approved | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C7H8N4O2
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| Canonical SMILES |
CN1C=NC2=C1C(=O)NC(=O)N2C
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| InChI |
1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)
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| InChIKey |
YAPQBXQYLJRXSA-UHFFFAOYSA-N
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| CAS Number |
CAS 83-67-0
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| PubChem Compound ID | ||||
| PubChem Substance ID |
9683, 71209, 856014, 3140386, 5643001, 7836011, 8144898, 8149609, 8153341, 10321963, 10536794, 11111887, 11111888, 11335786, 11361025, 11362847, 11365409, 11367971, 11371358, 11373805, 11376133, 11461997, 11466902, 11468022, 11484785, 11486604, 11488801, 11490095, 11492218, 11493867, 11528351, 11537624, 12016149, 15120610, 17405743, 21317891, 24277679, 24697529, 26612003, 26679414, 26747084, 26747085, 26751592, 29224481, 38230076, 46508574, 47216765, 47216766, 47291118, 47515310
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| ChEBI ID |
CHEBI:28946
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| SuperDrug ATC ID |
C03BD01; R03DA07
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| References | Top | |||
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| REF 1 | Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015 | |||
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