8-[(2E)-2-[(5-BROMO-2-HYDROXYPHENYL)METHYLIDENE]HYDRAZINYL]-7-[(E)-BUT-2-ENYL]-3-METHYLPURINE-2,6-DIONE

CAS号
CCD编号
CCD08080874
分子式
C17 H17 Br N6 O3
分子量
433.264

基本信息

产品名称: 8-[(2E)-2-[(5-BROMO-2-HYDROXYPHENYL)METHYLIDENE]HYDRAZINYL]-7-[(E)-BUT-2-ENYL]-3-METHYLPURINE-2,6-DIONE
英文同义词: 8-[(2E)-2-[(5-BROMO-2-HYDROXYPHENYL)METHYLIDENE]HYDRAZINYL]-7-[(E)-BUT-2-ENYL]-3-METHYLPURINE-2,6-DIONE
MDL号: MFCD01555404
氢键受体数量: 9
氢键供体数量: 3
Smile: C/C=C/Cn1c2c(=O)[nH]c(=O)n(c2nc1N/N=C/c3cc(ccc3O)Br)C
InChi: InChI=1S/C17H17BrN6O3/c1-3-4-7-24-13-14(23(2)17(27)21-15(13)26)20-16(24)22-19-9-10-8-11(18)5-6-12(10)25/h3-6,8-9,25H,7H2,1-2H3,(H,20,22)(H,21,26,27)/b4-3+,19-9+
InChiKey: InChIKey=MXSCJHPJNRHCDG-ZUNGZNNASA-N

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