(2S,3R,4S,5S,6R)-2-(((2S,3R,4S,5R,6R)-2-(((2R,3R,4R,5R,6R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-(((2aS,4S,5’S,6aS,6bS,8aS,8bR,9S,10S,11aS,12aS,12bR)-5’,6a,8a,9-Tetramethyloctadecahydrospiro[Naphtho[2’,1’:4,5]Indeno[2,1-B]Furan-10,2’-Piperidin]-4-Yl)Oxy)Tetra (2S,3R,4S,5S,6R)-2-(((2S,3R,4S,5R,6R)-2-(((2R,3R,4R,5R,6R)-4,5-二羟基-2-(羟甲基)-6-(((2aS,4S,5’S,6aS,6bS,8aS,8bR,9S,10S,11aS,12aS,12bR)-5’,6a,8a,9-四甲基十八氢螺[萘并[2’,1’:4,5]茚并[2,1-b]呋喃-10,2’-哌啶]-4-基)氧基)四氢-2H-吡喃-3-基)氧基)-5-羟基-6-(羟甲基)-4-(((2S,3R,4S,5R)-3,4,5-三羟基四氢-2H-吡

CAS 17406-45-0 MFCD00016888

化学结构图

17406-45-0
SMILES: C[C@@H]1CNC2(CC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@H](CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C)O[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

化学属性

Mol. FormulaC50H83NO21
Mol. Weight1034.20

别名和识别编码

Chemical Name(2S,3R,4S,5S,6R)-2-(((2S,3R,4S,5R,6R)-2-(((2R,3R,4R,5R,6R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-(((2aS,4S,5’S,6aS,6bS,8aS,8bR,9S,10S,11aS,12aS,12bR)-5’,6a,8a,9-Tetramethyloctadecahydrospiro[Naphtho[2’,1’:4,5]Indeno[2,1-B]Furan-10,2’-Piperidin]-4-Yl)Oxy)Tetra
MDL NumberMFCD00016888
CAS Number17406-45-0
Chemical Name Translation(2S,3R,4S,5S,6R)-2-(((2S,3R,4S,5R,6R)-2-(((2R,3R,4R,5R,6R)-4,5-二羟基-2-(羟甲基)-6-(((2aS,4S,5’S,6aS,6bS,8aS,8bR,9S,10S,11aS,12aS,12bR)-5’,6a,8a,9-四甲基十八氢螺[萘并[2’,1’:4,5]茚并[2,1-b]呋喃-10,2’-哌啶]-4-基)氧基)四氢-2H-吡喃-3-基)氧基)-5-羟基-6-(羟甲基)-4-(((2S,3R,4S,5R)-3,4,5-三羟基四氢-2H-吡
Reaxys-RN78250
Merck Number9545
PubChem Substance ID354334699
Synonym A''-Tomatidine alpha-Tomatine Tomatidine, glycoside Lycopersicin Tomatin
Beilstein Registry Number0078250
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相关文献及参考

  • [1]. da Silva DC, et al. Neurotoxicity of the steroidal alkaloids tomatine and tomatidine is RIP1 kinase- and caspase-independent and involves the eIF2α branch of the endoplasmic reticulum. J Steroid Biochem Mol Biol. 2017 Jul;171:178-186.

安全信息

RTECSXW1050000
Signal word
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P301+P312+P330
  • 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。
GHS Symbol
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85GDA2 "CRC Handbook of Antibiotic Compounds," Vols.1- ,  Berdy, J., Boca
   Raton, FL, CRC Press, 1980-  Volume(issue)/page/year: 8(2),218,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,61,1979

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 25 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SZAPAC Schweizerische Zietschrift fuer Allgemeine Pathologie und
   Bakteriologie.  (White Plains, NY) V.1-3, 1938-40; V.13-22, 1950-59.  For
   publisher information, see ECEBDI.  Volume(issue)/page/year: 22,557,1959

TYPE OF TEST            : DNA inhibition
TEST SYSTEM             : Microorganism - not otherwise specified
DOSE/DURATION           : 25 ppm
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,61,1979

TYPE OF TEST            : Mutation test systems - not otherwise specified
TEST SYSTEM             : Microorganism - not otherwise specified
DOSE/DURATION           : 25 ppm
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,61,1979

系列性分类


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