Methyl 13-ethylidene-10-hydroxy-18-(hydroxymethyl)-15-methyl-8-aza-15-azoniapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,4,6-triene-18-carboxylate

CAS 6871-44-9 MFCD01939553

化学结构图

6871-44-9
SMILES: C/C=C1/C[N+]2(C)CC[C@@]34c5ccccc5N[C@]32[C@@H](O)C[C@@H]1[C@]4(CO)C(=O)OC

化学属性

Mol. FormulaC22H29N2O4
Mol. Weight385.53

别名和识别编码

Chemical Name2,4(1H)-Cyclo-3,4-secoakuammilanium,3,17-dihydroxy-16-(methoxycarbonyl)-4-methyl-,(3-beta,16R)-
Synonym Ditaine Echitamine ditaine echitamine echitamine chloride, (3beta,16R)-isomer
Beilstein Registry Number4164538
CAS Number6871-44-9
PubChem Substance ID431721
InChIInChI=1S/C22H29N2O4/c1-4-14-12-24(2)10-9-21-15-7-5-6-8-17(15)23-22(21,24)18(26)11-16(14)20(21,13-25)19(27)28-3/h4-8,16,18,23,25-26H,9-13H2,1-3H3/q+1
LabNetwork Molecule IDLN04634131
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安全信息

RTECSGZ3500000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 70500 ug/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   IJCREE International Journal of Crude Drug Research.  (Swets & Zeitlinger
   B.V., POB 825, 2160 SZ Lisse, Netherlands)  V.20-    1982-
   Volume(issue)/page/year: 22,121,1984

系列性分类

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