HCID10245047

Avenanthramide E

2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid

C17H15NO5313.3 g/molCAS 93755-77-2

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IDENTITY

结构与身份

标准SMILES: COc1cc(/C=C/C(=O)Nc2ccccc2C(=O)O)ccc1O
InChIKey: FSKJPXSYWQUVGO-VQHVLOKHSA-N
分子式: C17H15NO5
平均分子量: 313.3 g/mol
单同位素质量: 313.09502258

COMPUTED

结构计算性质

已同步

XLogP: 2.9
极性表面积: 95.9 Å²
氢键供体: 3
氢键受体: 5
可旋转键: 5
重原子: 23
形式电荷: 0
复杂度: 450

PHARMACOLOGY

药理信息

来源：PubChem

Cellular Locations

Membrane

ALIASES

名称与别名

共 35 条

Avenanthramide E93755-77-2Avenanthramide 1fSB9MUF0VRTUNII-SB9MUF0VRTAvenanthramide E (Collins)2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid2-(((2E)-3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl)amino)benzoic acid2-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamido]benzoic acidBenzoic acid, 2-(((2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl)amino)-Benzoic acid, 2-((3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl)amino)-, (E)-N-[4-Hydroxy-3-methoxy-(E)cinnamoyl]-anthranilic acidN-(4-Hydroxy-3-methoxy-(e)cinnamoyl)-anthranilic acid2-((2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamido)benzoic acid2-(((E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl)amino)benzoic acid2-(((2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene)amino)benzoate2-{[(2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]amino}benzoateRefChem:1157504-Demethyl Tranilast(E)-2-[[3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]amino]benzoic Acid

REACTIONS

参与反应

3 条

uspto-grants-2014_07 · 10.6084/m9.figshare.5104873.v1 · US08765812B2

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uspto-grants-2015_06 · 10.6084/m9.figshare.5104873.v1 · US09062076B2

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uspto-grants-2015_06 · 10.6084/m9.figshare.5104873.v1 · US09062076B2

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