基本信息 |
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产品名称: | 咖啡君 |
CAS: | 58166-83-9 |
中文同义词: | 咖啡君 |
英文同义词: | CAFEDRINE |
MDL号: | MFCD00865826 |
氢键受体数量: | 8 |
氢键供体数量: | 2 |
Smile: | CC(C(c1ccccc1)O)NCCn2cnc3c2c(=O)n(c(=O)n3C)C |
InChi: | InChI=1S/C18H23N5O3/c1-12(15(24)13-7-5-4-6-8-13)19-9-10-23-11-20-16-14(23)17(25)22(3)18(26)21(16)2/h4-8,11-12,15,19,24H,9-10H2,1-3H3 |
InChiKey: | InChIKey=UJSKUDDDPKGBJY-UHFFFAOYSA-N |
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