S-(2-Carboxyethyl)-L-cysteine S-(2-羧乙基)-L-半胱氨酸

CAS 4033-46-9 MFCD03424208

化学结构图

4033-46-9
SMILES: N[C@@H](CSCCC(=O)O)C(=O)O

化学属性

Mol. Weight193.22
Mol. FormulaC6H11NO4S
Melting Point218 °C
Boiling Point96.5 °C at 760 mmHg

别名和识别编码

Chemical NameS-(2-Carboxyethyl)-L-cysteine
Alfabeta NameAMINOCARBOXYETHYLSULFANYLPROPANOICACID R2232[](())------
MDL NumberMFCD03424208
CAS Number4033-46-9
Reaxys-RN1725406
Chemical Name TranslationS-(2-羧乙基)-L-半胱氨酸
PubChem Substance ID23618202
InChIKeyFBPINGSGHKXIQA-BYPYZUCNSA-N
Wiswesser Line NotationQVYZ1S2VQ
Synonym S-(2-Carboxyethyl)-L-cysteine {LY} S-(2-Carboxyethyl)-L-cysteine {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} S-(2-Carboxyethyl)-L-cysteine {} {} {} {} {} {} {} {} {} {} {} {}
Beilstein Registry Number1725406
LabNetwork Molecule IDLN00167548
InChIInChI=1S/C6H11NO4S/c7-4(6(10)11)3-12-2-1-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)/t4-/m0/s1
Canonical SMILESC(CSC[C@@H](C(=O)O)N)C(=O)O
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分类

  • {KO} alpha-Amino Acids

安全信息

Warnings IRRITANT
RTECSAY4300000 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 520 mg/kg/52W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   BJCAAI British Journal of Cancer.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.1-    1947-  Volume(issue)/page/year:
   15,85,1961

Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H332 Harmful if inhaled 吸入有害
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P312
  • P304+P340
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P317
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
5
Rotatable Bonds
6
H-bond Donors
3
LogP
-8.752000000000001e-001

系列性分类

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