结构:Cc1[nH]cnc1CN1CCc2c(c3ccccc3n2C)C1=O
HCID2099

Alosetron

5-Methyl-2-[(4-methyl-1H-imidazol-5-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one

C17H18N4O294.358 g/molCAS 122852-42-0

IDENTITY

结构与身份

标准 SMILES
Cc1[nH]cnc1CN1CCc2c(c3ccccc3n2C)C1=O
InChIKey
JSWZEAMFRNKZNL-UHFFFAOYSA-N
分子式
C17H18N4O
平均分子量
294.358 g/mol
单同位素质量
294.1480612
扩展信息尚未完成同步。

REACTIONS

参与反应

21
HRID125219

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为生成物
HRID 125219 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID297715

Training data from https://doi.org/10.1039/C8SC04228D (8/10)

作为反应物
HRID 297715 方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看条件与参与物
HRID937523

Validation data from https://doi.org/10.1039/C8SC04228D

作为生成物
HRID 937523 方程式

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

查看条件与参与物
HRID1217666

Training data from https://doi.org/10.1039/C8SC04228D (5/10)

作为生成物
HRID 1217666 方程式

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看条件与参与物