方案
≥98.0%
mp
345-350 °C
溶解性
H2O: slightly soluble
aqueous base: moderately soluble
ethanol: slightly soluble
SMILES字符串
[H]N1C(N(C)C2=C(N(C)C=N2)C1=O)=O
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)
InChI key
YAPQBXQYLJRXSA-UHFFFAOYSA-N
基因信息
human ... ADORA1(134), ADORA2A(135), ADORA2B(136), ADORA3(140)
rat ... Adora1(29290)
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一般描述
Theobromine is a methylxanthine alkaloid derivative, highly present in cocoa.
应用
Theobromine has been used:
- to test in behavioural assay
- as a food or dietary supplement
- as a standard for theobromine quantification in brewed coffee samples
生化/生理作用
Phosphosdiesterase inhibitor; weak adenosine receptor antagonist; diuretic; smooth muscle relaxant.
Theobromine possesses antitussive action and might be useful in treating acute and chronic cough. It is a catabolic product of caffeine and shows antioxidant and prooxidant properties.
特点和优势
This compound is a featured product for Cyclic Nucleotide research. Click here to discover more featured Cyclic Nucleotide products. Learn more about bioactive small molecules for other areas of research at sigma.com/discover-bsm.
制备说明
Theobromine is moderately soluble in aqueous base and is slightly soluble in water and ethanol.
警示用语：
Warning
危险声明
危险分类
Acute Tox. 4 Oral - Eye Irrit. 2
储存分类代码
11 - Combustible Solids
WGK
WGK 1
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
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