(5aR,6S,8R,9S,10R,11R,11As,12Ar,13R)-9-Ethyl-5-Methyl-5A,6,8,9,10,11,11A,12-Octahydro-5H-6,10:11,12A-Dimethanoindolo[3,2-B]Quinolizine-8,13-Diol (5aR,6S,8R,9S,10R,11R,11aS,12aR,13R)-9-乙基-5-甲基-5a,6,8,9,10,11,11a,12-八氢-5H-6,10:11,12a-二甲桥吲哚并[3,2-b]喹啉-8,13-二醇

CAS 4360-12-7 MFCD00135652

化学结构图

4360-12-7
SMILES: CC[C@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@@H]2[C@H]5O)N3[C@@H]1O

化学属性

Mol. FormulaC20H26N2O2
Mol. Weight326

别名和识别编码

Chemical Name(5aR,6S,8R,9S,10R,11R,11As,12Ar,13R)-9-Ethyl-5-Methyl-5A,6,8,9,10,11,11A,12-Octahydro-5H-6,10:11,12A-Dimethanoindolo[3,2-B]Quinolizine-8,13-Diol
CAS Number4360-12-7
Synonym Ajmalan-17,21-diol, (17R,21-alpha)- (+)-Ajmaline Merabitol Rauwolfine Rhytmaton Ritmos Takycor Tajmalin Rytmalin Tachmalin Ignazin Cardiorythmine Raugalline (17R,21?-Ajmalan-17,21-diol NSC 15627 Gilurytmal Rauwolfin Siddiqui Ajmalin
MDL NumberMFCD00135652
EC Number224-439-4
Chemical Name Translation(5aR,6S,8R,9S,10R,11R,11aS,12aR,13R)-9-乙基-5-甲基-5a,6,8,9,10,11,11a,12-八氢-5H-6,10:11,12a-二甲桥吲哚并[3,2-b]喹啉-8,13-二醇
Wiswesser Line NotationT5 F6 E56 B6 B6/CR/NS A 5BBCEO S EX LN ONT&TTTTJ DQL1 PQ Q2
PubChem Substance ID6100671
InChIInChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16-,17-,18+,19+,20+/m0/s1
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分类

  • Pharmaceuticals
  • Intermediates & Fine Chemicals

产品应用

  • An antiarrhythmic agent isolated from Rauwolfia serpentina.

相关文献及参考

  • Galarreta, B., et al.: Bioorg. Med. Chem., 16, 6689 (2008),
  • Sun, L., et al.: Plant Mol. Biol., 67, 455 (2008),
  • Ruiz-May, E., et al.: Mol. Biotechnol., 41, 278 (2009),

安全信息

GHS Symbol
WGK Germany3
Precautionary statements
  • 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。
Hazard statements
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
RTECSAX8050000
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 360 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - ataxia
REFERENCE :
   PHARAT Pharmazie.  (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18,
   Berlin DDR-1020, Ger. Dem. Rep.)  V.1-    1946-  Volume(issue)/page/year:
   31,39,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 75 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: AD691-490

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - wild bird species
DOSE/DURATION           : 178 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AECTCV Archives of Environmental Contamination and Toxicology.
   (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ
   070944)  V.1-    1973-  Volume(issue)/page/year: 12,355,1983

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - quail
DOSE/DURATION           : 316 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EESADV Ecotoxicology and Environmental Safety.  (Academic Press, Inc., 1 E.

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