12a-Hydroxyrotenone

CAS 509-96-6 MFCD00509966

化学结构图

509-96-6
SMILES: C=C(C)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2(O)C3=O)O1

化学属性

Mol. Weight410.45
Mol. FormulaC23H22O7

别名和识别编码

Chemical NameRotenolone
Chemicalbook IDCB41484379
Wiswesser Line NotationT G5 D6 B666 CV HO MO PO OHJ
Synonym 12-hydroxyrotenone 12a-Hydroxyrotenone 6 alpha(beta),12 alpha(beta)-rotenolone 6a-beta,12a-beta-Rotenolone Rotenalone Rotenolone Rotenolone I rotenolone rotenolone, (2R-(2alpha,6aalpha,12aalpha))-isomer rotenolone, (2R-(2alpha,6aalpha,12abeta))-isomer rotenolone, (2R-(2alpha,6abeta,12aalpha))-isomer
CAS Number509-96-6
InChIKeyJFVKWCYZKMUTLH-AYPBNUJASA-N
PubChem Substance ID68184
InChIInChI=1S/C23H22O7/c1-11(2)16-7-13-15(29-16)6-5-12-21(13)30-20-10-28-17-9-19(27-4)18(26-3)8-14(17)23(20,25)22(12)24/h5-6,8-9,16,20,25H,1,7,10H2,2-4H3/t16-,20-,23-/m1/s1
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安全信息

RTECSDJ2625000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4100 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EVHPAZ EHP, Environmental Health Perspectives.  (U.S. Government Printing
   Office, Supt of Documents, Washington, DC 20402)  No.1-    1972-
   Volume(issue)/page/year: 14,109,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4100 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SCIEAS Science.  (American Assoc. for the Advancement of Science, 1333 H
   St., NW, Washington, DC 20005)  V.1-    1895-  Volume(issue)/page/year:
   155,713,1967

系列性分类

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