Caracurinium II, 17,18:17',18'-dideepoxy-17,17'-dihydroxy-4,4'-dimethyl-

CAS 6902-18-7 MFCD06902187

化学结构图

6902-18-7
SMILES: C/C=C1/C[N@+]2(C)CC[C@]34c5ccccc5N5[C@@H]3[C@]3([C@H](O)N6c7ccccc7[C@]78CC[N@@+]9(C)C/C(=C/C)[C@@H](C[C@H]79)[C@]3([C@@H]68)[C@H]5O)[C@@H]1C[C@@H]42

化学属性

Mol. Weight616.92
Mol. FormulaC40H48N4O2

别名和识别编码

Synonym C-Alkaloid D 17,18:17',18'-Dideepoxy-17,17'-dihydroxy-4,4'-dimethylcaracurinium II
Chemical NameCaracurinium II, 17,18:17',18'-dideepoxy-17,17'-dihydroxy-4,4'-dimethyl-
CAS Number6902-18-7
InChIKeyLKJAAUJOYKUJFG-XIBKSJEISA-N
PubChem Substance ID6444555
InChIInChI=1S/C40H48N4O2/c1-5-23-21-43(3)17-15-37-25-11-7-9-13-29(25)41-33(37)39(27(23)19-31(37)43)35(45)42-30-14-10-8-12-26(30)38-16-18-44(4)22-24(6-2)28(20-32(38)44)40(39,34(38)42)36(41)46/h5-14,27-28,31-36,45-46H,15-22H2,1-4H3/q+2/b23-5-,24-6-
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安全信息

RTECSEY5200000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2 mg/kg
TOXIC EFFECTS :
   Peripheral Nerve and Sensation - spastic paralysis with or without sensory
   change
REFERENCE :
   HPASAY Helvetica Physiologica et Pharmacologica Acta, Supplementum. (Basel,
   Switzerland) No.1-18, 1943-67.  Discontinued. Volume(issue)/page/year:
   8,1,1953

系列性分类

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