7-(2-HYDROXY-3-((2-HYDROXY-2-(P-HYDROXYPHENYL)ETHYL)AMINO)PROPYL)THEOPHYLLINE

CAS号
62401-96-1
CCD编号
CCD00239702
分子式
C18 H23 N5 O5
分子量
389.41

基本信息

产品名称: 7-(2-HYDROXY-3-((2-HYDROXY-2-(P-HYDROXYPHENYL)ETHYL)AMINO)PROPYL)THEOPHYLLINE
CAS: 62401-96-1
英文同义词: 7-(2-HYDROXY-3-((2-HYDROXY-2-(P-HYDROXYPHENYL)ETHYL)AMINO)PROPYL)THEOPHYLLINE
MDL号: MFCD01682217
氢键受体数量: 10
氢键供体数量: 4
Smile: Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(CNCC(c3ccc(cc3)O)O)O
InChi: InChI=1S/C18H23N5O5/c1-21-16-15(17(27)22(2)18(21)28)23(10-20-16)9-13(25)7-19-8-14(26)11-3-5-12(24)6-4-11/h3-6,10,13-14,19,24-26H,7-9H2,1-2H3
InChiKey: InChIKey=HQNBNESOAWELHK-UHFFFAOYSA-N

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