结构:COc1c(N2CCNCC2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
HCID465562

PD 135042

1-Cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid

C18H20FN3O4361.373 g/molCAS 112811-57-1

IDENTITY

结构与身份

标准 SMILES
COc1c(N2CCNCC2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
InChIKey
XJCSNIFKGXSDGN-UHFFFAOYSA-N
分子式
C18H20FN3O4
平均分子量
361.373 g/mol
单同位素质量
361.14378434
扩展信息尚未完成同步。

REACTIONS

参与反应

10
HRID153705

Training data from https://doi.org/10.1039/C8SC04228D (9/10)

作为生成物
HRID 153705 方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID185519

Training data from https://doi.org/10.1039/C8SC04228D (6/10)

作为生成物
HRID 185519 方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID938738

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

作为生成物
HRID 938738 方程式

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

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HRID1561099

Training data from https://doi.org/10.1039/C8SC04228D (1/10)

作为反应物
HRID 1561099 方程式

Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

查看条件与参与物