3,4,5-Trimethoxycinnamic Acid 3,4,5-三甲氧基肉桂酸

CAS 90-50-6 MFCD00004388

化学结构图

90-50-6
SMILES: COc1cc(/C=C/C(=O)O)cc(OC)c1OC

化学属性

Mol. FormulaC12H14O5
Mol. Weight238.24
Melting Point125-127°C
TSCAYes
Boiling Point396.4°C at 760 mmHg
Flash Point151.5°C

别名和识别编码

Chemical Name3,4,5-Trimethoxycinnamic Acid
CAS Number90-50-6
Alfabeta NameTRIMETHOXYPHENYLACRYLICACID E23345(())---,,
MDL NumberMFCD00004388
PubChem Substance ID735755
EC Number201-999-8
Beilstein Registry Number1537834
Synonym 3,4,5-Trimethoxycinnamic acid {LY} 3,4,5-Trimethoxycinnamic acid {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,4,5-Trimethoxycinnamic acid {} {} {} {} {} {} {} {} {}
Chemical Name Translation3,4,5-三甲氧基肉桂酸
Reaxys-RN1537834
InChIKeyYTFVRYKNXDADBI-SNAWJCMRSA-N
InChIInChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+
Canonical SMILESCOC1=C(OC)C(OC)=CC(/C=C/C(O)=O)=C1
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分类

  • {SA} Building Blocks, C11 to C12, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • Building Blocks, C11 to C12, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SNA} Additional Standards, Alphabetical Index of Phytochemical Standards, Analytical Standards, Chromatography, Life Sciences Standards, Natural Compounds, Phenylpropanes, Phytochemical Standards, S - Z, 分析/色谱

相关文献及参考

  • [2]. Lee CI, et al. 3,4,5-Trimethoxycinnamic acid (TMCA), one of the constituents of Polygalae Radix enhances pentobarbital-induced sleeping behaviors via GABAAergic systems in mice. Arch Pharm Res. 2013 Oct;36(10):1244-51.
  • Beil. 10 ,IV,2104
  • FT-IR 1 (2), 185:A / FT-IR 2 (2), 2644:B / FT-NMR 1 (2), 1059:B / IR-Spectra (2), 836:G / IR-Spectra (3), 955:F / NMR-Reference 2 (2), 181:D / RegBook 1 (2), 1779:G / Sigma FT-IR 1 (2), 954:D / Structure Index 1 , 284:C:3
  • [1]. Kawashima K, et al. Anti-stress effects of 3,4,5-trimethoxycinnamic acid, an active constituent of roots of Polygala tenuifolia (Onji). Biol Pharm Bull. 2004 Aug;27(8):1317-9.
  • [1]. Kawashima K, et al. Anti-stress effects of 3,4,5-trimethoxycinnamic acid, an active constituent of roots of Polygala tenuifolia (Onji). Biol Pharm Bull. 2004 Aug;27(8):1317-9.
  • [2]. Lee CI, et al. 3,4,5-Trimethoxycinnamic acid (TMCA), one of the constituents of Polygalae Ra

安全信息

Warnings IRRITANT
WGK Germany2
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
RTECSGE0722000
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
GHS Symbol
Signal word
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P332+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - wild bird species
DOSE/DURATION           : 422 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AECTCV Archives of Environmental Contamination and Toxicology.
   (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ
   070944)  V.1-    1973-  Volume(issue)/page/year: 12,355,1983

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

系列性分类

  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Organic Acids - Synthetic Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C11 to C12 - Carboxylic Acids
  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)

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