Digoxin 地高辛

CAS 20830-75-5 MFCD00003674

化学结构图

20830-75-5
SMILES: C[C@]12CC[C@@H](C[C@H]1CC[C@@H]1[C@@H]2C[C@@H](O)[C@]2(C)[C@H](CC[C@@]21O)C1COC(=O)C=1)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](O)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1

化学属性

Mol. FormulaC41H64O14
Mol. Weight780.95
Melting Point260-262
TSCAYes
Density1.36

别名和识别编码

Chemical NameDigoxin
CAS Number20830-75-5
Synonym Chloroformic digitalin Digoksyna Homolle's digitalin Rougoxin (3?,5?,12?)-3-[(O-2,6-Dideoxy-?-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-?-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-?-D-ribo-hexopyranosyl)oxyl]-12,14-dihydroxycard-20(22)-enolide L Digitalis glycoside SK-Digoxin Lanoxin Digacin Digoxigenin-tridigitoxosid Digoxine 异羟基洋地黄毒苷 地高辛; 狄高辛; 异羟基洋地黄毒苷; 毛地黄叶毒苷 Lanicor Dilanacin
PubChem Substance ID87568294
EC Number244-068-1
Beilstein Registry Number18(3/4)2453
MDL NumberMFCD00003674
Merck Number3167
Chemical Name Translation地高辛
Reaxys-RN77011
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分类

  • Alphabetic, Analytical Standards, Analytical/Chromatography, Application Index, Bioactive Small Molecules, Biochemicals and Reagents, Cell Biology, Cell Signaling Enzymes, Cell Signaling and Neuroscience, Chemical Structure, Chromatography, Conjugates, D, DID - DIN, DIG-DY, Drug Efflux Pumps, Drugs & Metabolites, Drugs of Abuse, Enzymes, Inhibitors, and Substrates, Forensic and Veterinary Standards, Lipids, Multi-Drug Resistance, Multi-Drug Resistance and Drug Metabolism, Neat Compounds, Steroid,
  • {SNA} 1694 Pharmaceu

产品应用

  • 一种强心苷(cardiac glycoside),为Pgp的底物,增强调控Pgp的表达和减弱调控SXR(类固醇源化学物受体)。

相关文献及参考

  • Aronson, J.K., et al.: Clin. Pharmacokinet, 5,137 (1980),
  • Foss, P.R.B., Anal. Profiles Drug Subs., 9, 207 (1980),
  • Merck: 14,3167
  • Merck: 14,3167 Beilstein: 18,V,4,381
  • [1]. Ashbrook AW, et al. Antagonism of the Sodium-Potassium ATPase Impairs Chikungunya Virus Infection. MBio. 2016 May 24;7(3). pii: e00693-16.

安全信息

GHS Symbol
WGK Germany3
Hazard Codes T
Hazard statements
  • H300 Fatal if swallowed 吞食致命
  • H300+H330
Personal Protective Equipment Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
RTECSIH6125000
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前,切勿操作。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/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。
  • 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。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P301+P310
  • P301+P310+P330
  • P308+P313
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word
Safety Statements
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S20 When using do not eat or drink 使用时,不得进食,饮水;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S22 Do not breathe dust 不要吸入粉尘;
UN Number 1544 3462 UN2811
Risk Statements
Packing GroupII
Storage condition 储存温度2-8℃
Restrict 剧毒化学品
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Parenteral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2947 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SIHSD8 Shang-hai I Hsueh.  (China International Book Trading Corp., POB
   2820, Beijing, Peop. Rep. China)  V.1-    1978(?)- Volume(issue)/page/year:
   4(2),32,1981

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Human - man
DOSE/DURATION           : 13 ug/kg/4D-I
TOXIC EFFECTS :
   Behavioral - changes in psychophysiological tests
   Vascular - other changes
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   AHJOA2 American Heart Journal.  (C.V. Mosby Co., 11830 Westline Industrial
   Dr., St. Louis, MO 6314

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 8900 ng/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   RPTOAN Russian Pharmacology and Toxicology (English Translation).
   Tr

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - dog
DOSE/DURATION           : 200 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CRSBAW Comptes Rendus des Seances de la Societe de Biologie et de Ses
   Filiales.  (SPPIF, B.P.22, F-41353 Vineuil, France)  V.1-    1849-
   Volume(issue)/page/year: 109,279,1932

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROU

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - wo

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Mammal - domestic
DOSE                    : 810 ug/kg
SEX/DURATION            : female 1-18 week(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - blood and lymphatic
   systems (including spleen and marrow)
REFERENCE :
   AJOGAH American Journal of Obstetrics and Gynecology.  (C.V. Mosby Co.,
   11830 Westline Industrial Dr., St. Louis, MO 63146)  V.1-    1920-
   Volume(issue)/page/year: 121,1100,1975

Hazard Class6.1

系列性分类


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