Valine, 3-mercapto-, hydrochloride, D- (S)-2-氨基-3-巯基-3-甲基丁酸盐酸盐

CAS 2219-30-9 MFCD00136690

化学结构图

2219-30-9
SMILES: CC(C)(S)[C@@H](N)C(=O)O.Cl

化学属性

Mol. FormulaC5H12ClNO2S
Mol. Weight185.67

别名和识别编码

Chemical NameValine, 3-mercapto-, hydrochloride, D-
Synonym (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {} {} {} {} {LY} (S)-2-Amino-3-mercapto-3-methylbutanoic acid (hydrochloride) {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00136690
EC Number218-727-9
Wiswesser Line NotationSHX1&1&YZVQ &GH -D
CAS Number2219-30-9
Chemical Name Translation(S)-2-氨基-3-巯基-3-甲基丁酸盐酸盐
PubChem Substance ID92173
InChIInChI=1S/C5H11NO2S.ClH/c1-5(2,9)3(6)4(7)8;/h3,9H,6H2,1-2H3,(H,7,8);1H/t3-;/m0./s1
Canonical SMILESN[C@H](C(C)(S)C)C(O)=O.[H]Cl
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安全信息

WGK Germany3
RTECSYV9450000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2170 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ANTBAL Antibiotiki.  (Moscow, USSR)  V.1-29, 1956-84.  For publisher
   information, see AMBIEH.  Volume(issue)/page/year: 14,837,1969

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - man
DOSE/DURAT

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD277-689

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human
DOSE/DURATION           : 5460 mg/kg
TOXIC EFFECTS :
   Skin and Appendages - dermatitis, other (after systemic exposure)
REFERENCE :
   BMJOAE British Medical Journal.  (British Medical Assoc., BMA House,
   Tavistock Sq., London WC1H 9JR, UK)  V.1-    1857- Volume(issue)/page/year:
   1,838,1977

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3670 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ANTBAL Antibiotiki.  (Moscow, USSR)  V.1-29, 1956-84.  For publisher
   information, see AMBIEH.  Volume(issue)/page/year: 14,837,1969

TYPE OF TEST            : LD50 -

Storage condition

系列性分类

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