Tyrosine, beta,3-dihydroxy- rel-(2R,3S)-2-氨基-3-(3,4-二羟基苯基)-3-羟基丙酸

CAS 3916-18-5 MFCD00004266

化学结构图

3916-18-5
SMILES: NC(C(=O)O)C(O)c1ccc(O)c(O)c1

化学属性

Mol. FormulaC9H11NO5
Mol. Weight213.19
Melting Point202-205 °C
Boiling Point549.8±50.0 °C at 760 mmHg

别名和识别编码

Chemical NameTyrosine, beta,3-dihydroxy-
MDL NumberMFCD00004266
CAS Number3916-18-5
Chemical Name Translation rel-(2R,3S)-2-氨基-3-(3,4-二羟基苯基)-3-羟基丙酸
InChIKeyQXWYKJLNLSIPIN-JAMMHHFISA-N
Synonym rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} rel-(2R,3S)-2-Amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid {} {} {} {} {} {} {}
PubChem Substance ID92974
Wiswesser Line NotationQVYZYQR CQ DQ
Beilstein Registry Number2852792
InChIInChI=1S/C9H11NO5/c10-7(9(14)15)8(13)4-1-2-5(11)6(12)3-4/h1-3,7-8,11-13H,10H2,(H,14,15)/t7-,8+/m0/s1
Canonical SMILESN[C@H]([C@@H](O)C1=CC=C(O)C(O)=C1)C(O)=O
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分类

  • {SNA} Adrenergics, Neuroscience, Neurotransmission, Neurotransmitters, Others, 细胞信号转导和神经科学, 细胞生物学

安全信息

Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
Hazard Codes Xi
GHS Symbol
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
WGK Germany3
Signal word Warning
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
RTECSVT9626000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >10 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JKXXAF Japanese Kokai Tokyo Koho Patents.  (U.S. Patent and Trademark
   Office, Foreign Patents, Washington, DC 20231)  Volume(issue)/page/year:
   #81-104815

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 10 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JKXXAF Japanese Kokai Tokyo Koho Patents.  (U.S. Patent and Trademark
   Office, Foreign Patents, Washington, DC 20231)  Volume(issue)/page/year:
   #81-104815

Storage condition

系列性分类

  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Bioactive Small Molecules - Cell Biology
  4. DIG-DY - Bioactive Small Molecules
  1. Functional Group 官能团索引
  2. 1,2-diphenol

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