1-​Penten-​3-​ol, 1-​(1,​3-​benzodioxol-​5-​yl)​-​4,​4-​dimethyl- 1-(1,3-苯并二恶英-5-基)-4,4-二甲基-1-戊烯-3-醇

CAS 49763-96-4 MFCD00869310

化学结构图

49763-96-4
SMILES: CC(C)(C)C(O)/C=C/C1C=C2OCOC2=CC=1

化学属性

Mol. FormulaC14H18O3
Mol. Weight234.30
Melting Point75.0 to 79.0 deg-C

别名和识别编码

Chemical Name1-​Penten-​3-​ol, 1-​(1,​3-​benzodioxol-​5-​yl)​-​4,​4-​dimethyl-
CAS Number49763-96-4
Synonym 1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol 1-(1,3-Benzodioxol-5yl)-4,4-dimethyl-1-penten-3-ol 1-Penten-3-ol, 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl- 4,4-Dimethyl-1-(3,4-methylenedioxyphenyl)-1-penten-3-ol 4,4-dimethyl-1-[3,4(methylenedioxy)-phenyl]-1-penten-3-ol Diacomit BCX 2600 Stiripentol
MDL NumberMFCD00869310
EC Number256-480-9
Wiswesser Line NotationT56 BO DO CHJ G1U1YQX1&1&1
Beilstein Registry Number1313047
PubChem Substance ID253660381
Chemical Name Translation1-(1,3-苯并二恶英-5-基)-4,4-二甲基-1-戊烯-3-醇
Reaxys-RN1313047
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分类

  • Pharmaceuticals
  • {SNA} Bioactive Small Molecule Alphabetical Index, S, 生物活性小分子, 细胞生物学
  • {SNA} Bioactive Small Molecules, Cell Biology, S
  • Heterocycles
  • Intermediates & Fine Chemicals,

产品应用

  • An epilepsy drug. It has been used as co-therapy for treatment of epilepsy

相关文献及参考

  • [2]. Cao D, et al. Efficacy of stiripentol in hyperthermia-induced seizures in a mouse model of Dravet syndrome. Epilepsia. 2012 Jul;53(7):1140-5.
  • ########
  • [1]. Giraud C, et al. In vitro and in vivo inhibitory effect of stiripentol on clobazam metabolism.Drug Metab Dispos. 2006 Apr;34(4):608-11. Epub 2006 Jan 13.
  • [1]. Giraud C, et al. In vitro and in vivo inhibitory effect of stiripentol on clobazam metabolism.Drug Metab Dispos. 2006 Apr;34(4):608-11. Epub 2006 Jan 13.
  • [2]. Cao D, et al. Efficacy of stiripentol in hyperthermia-induced seizures in a mouse model of Dravet syndrome. Epilepsia. 2012 Jul;53(7):1140-5.

安全信息

GHS Symbol
Hazard statements
  • H302 Harmful if swallowed 吞食有害
WGK Germany3
Signal word Warning
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
RTECSSB3393000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >5 gm/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: 34,199,1984

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 72 mg/kg
TOXIC EFFECTS :
   Behavioral - anticonvulsant
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 34,199,1984

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1471 mg/kg
TOXIC EFFECTS :
   Behavioral - anticonvulsant
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 34,199,1984

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >3 gm/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: 34,199,1984

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

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 6400 mg/kg
SEX/DURATION            : female 2 week(s) pre-mating  - 18 day(s) after
                          conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - craniofacial
   (including nose and tongue)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   REPTED Reproductive Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1987-  Volume(issue)/page/year:
   7,439,1993

Storage condition <0°C

系列性分类

  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Bioactive Small Molecules - Cell Biology
  4. S - Bioactive Small Molecules
  1. Medical Research Areas
  2. Metabolism
  3. Cytochrome P450  (细胞色素P450)

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