750 AstraZeneca ELN dataset
查看IDENTITY
结构与身份
- 标准SMILES
- COc1cc(N)ccc1C#N
- InChIKey
- KTDRJLRJAHBQDQ-UHFFFAOYSA-N
- 分子式
- C8H8N2O
- 平均分子量
- 148.165 g/mol
- 单同位素质量
- 148.06366288
扩展信息尚未完成同步。
REACTIONS
参与反应
uspto-grants-2006_11 · 10.6084/m9.figshare.5104873.v1 · US07141578B2
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2010_11 · 10.6084/m9.figshare.5104873.v1 · US07834051B2
查看uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07655689B2
查看uspto-grants-2013_04 · 10.6084/m9.figshare.5104873.v1 · US08420694B2
查看uspto-grants-2009_04 · 10.6084/m9.figshare.5104873.v1 · US07517904B2
查看Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D
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