9-Azabicyclo(3.3.1)nonan-3-beta-ol, 9-phenethyl-, benzilate

CAS 6606-09-3 MFCD N/A

化学结构图

6606-09-3
SMILES: O=C(OC1C[C@H]2CCC[C@H](C1)N2CCc1ccccc1)C(O)(c1ccccc1)c1ccccc1

化学属性

Mol. Weight455.64
Mol. FormulaC30H33NO3

别名和识别编码

Wiswesser Line NotationT66 A ANTJ A2R& DOVXQR&R BETA
Chemical Name9-Azabicyclo(3.3.1)nonan-3-beta-ol, 9-phenethyl-, benzilate
Synonym N-Phenethyl-norgranatan-3-ol beta-(alpha-hydroxy-alpha-diphenylacetyl) 9-Phenethyl-9-azabicyclo(3.3.1)nonan-3-beta-ol benzilate KSD 2598
Beilstein Registry Number1557256
CAS Number6606-09-3
InChIKeyMBLNYIIHNHIOEF-UHFFFAOYSA-N
PubChem Substance ID23084
InChIInChI=1S/C30H33NO3/c32-29(30(33,24-13-6-2-7-14-24)25-15-8-3-9-16-25)34-28-21-26-17-10-18-27(22-28)31(26)20-19-23-11-4-1-5-12-23/h1-9,11-16,26-28,33H,10,17-22H2
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安全信息

RTECSCL5592000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 540 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 15,857,1965

系列性分类

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