1,7-Dimethyl-1H-Purine-2,6(3H,7H)-Dione 1,7-二甲基-1H-嘌呤-2,6(3H,7H)-二酮

CAS 611-59-6 MFCD00005727

化学结构图

611-59-6
SMILES: Cn1c(=O)[nH]c2ncn(C)c2c1=O

化学属性

Mol. FormulaC7H8N4O2
Mol. Weight180
Melting Point294-296 °C(lit.)

别名和识别编码

Chemical Name1,7-Dimethyl-1H-Purine-2,6(3H,7H)-Dione
MDL NumberMFCD00005727
CAS Number611-59-6
Synonym 1,7-Dimethyl-1H-purine-2,6-dione 2,6-Dihydroxy-1,7-dimethylpurine Paraxanthine 1,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione 1,7-Dimethyl-1H-purine-2,6-dione 2,6-Dihydroxy-1,7-dimethylpurine NSC 400018 Paraxanthine 1,7-Dimethylxanthine 1H-Purine-2,6-dione, 3,7-dihydro-1,7-dimethyl- 3,7-Dihydro-1,7-dimethyl-1H-purine-2,6-dione
Beilstein Registry Number197907
EC Number210-271-9
PubChem Substance ID24277678
Chemical Name Translation1,7-二甲基-1H-嘌呤-2,6(3H,7H)-二酮
Wiswesser Line NotationT56 BN DN FMVNVJ B1 H1
LabNetwork Molecule IDLN01292272
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分类

  • {SNA} Bioactive Small Molecule Alphabetical Index, Cyclic Nucleotide Metabolism, DIG-DY, G Proteins and Cyclic Nucleotides, Phosphodiesterase Inhibitors, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
  • {SNA} Bioactive Small Molecules, Cell Biology, Cell Signaling and Neuroscience, Cyclic Nucleotide Metabolism, DIG-DY, G Proteins and Cyclic Nucleotides, Phosphodiesterase Inhibitors
  • {SA} 1694 Pharmaceuticals & Personal Care Products, Analytical Standards, Analytical/Chromatography, Building Blocks, Chemical Synthesis, EPA, Heterocyclic Building Blocks, Method Specific, Neats, Purine

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
RTECSRV9380000
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
Storage condition room temp 
TYPE OF TEST            : Unscheduled DNA synthesis
TEST SYSTEM             : Human Cells - not otherwise specified
DOSE/DURATION           : 1 mmol/L
REFERENCE :
   BIOJAU Biophysical Journal.  (Rockefeller Univ. Press, 1230 York Ave., New
   York, NY 10021) V.1-    1960-  Volume(issue)/page/year: 35,665,1981

TYPE OF TEST            : DNA inhibition
TEST SYSTEM             : Human Cells - not otherwise specified
DOSE/DURATION           : 4 mmol/L
REFERENCE :
   BIOJAU Biophysical Journal.  (Rockefeller Univ. Press, 1230 York Ave., New
   York, NY 10021) V.1-    1960-  Volume(issue)/page/year: 35,665,1981

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 150 mg/L
REFERENCE :
   CSHSAZ Cold Spring Harbor Symposia on Quantitative Biology.  (Cold Spring
   Harbor Laboratory, POB 100, Cold Spring Harbor, NY 11724)  V.1-    1933-
   Volume(issue)/page/year: 16,337,1952

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 600 mg/kg
SEX/DURATION            : female 11-12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - eye/ear
   Reproductive - Specific Developmental Abnormalities - craniofacial
   (including nose and tongue)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   TJADAB Teratology, The International Journal of Abnormal Development. (Alan
   R. Liss, Inc., 41 E. 11th St., New York, NY 10003)  V.1-    1968-
   Volume(issue)/page/year: 34,279,1986

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. DIG-DY - Bioactive Small Molecules
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Purines 嘌呤
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. G Proteins and Cyclic Nucleotides - Cell Signaling and Neuroscience
  5. Cyclic Nucleotide Metabolism - G Proteins and Cyclic Nucleotides
  6. Phosphodiesterase Inhibitors - Cyclic Nucleotide Metabolism

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