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29346-20-1,MFCD27948886
Catalog No.:AA002Y1L

29346-20-1 | 2,4,6-Cycloheptatrien-1-one, 2,3-dihydroxy-5-(1-methylethyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$389.00   $272.00
- +
250mg
95%
in stock  
$727.00   $509.00
- +
1g
95%
in stock  
$2,436.00   $1,706.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002Y1L
Chemical Name:
2,4,6-Cycloheptatrien-1-one, 2,3-dihydroxy-5-(1-methylethyl)-
CAS Number:
29346-20-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD27948886
SMILES:
CC(c1ccc(=O)c(c(c1)O)O)C
NSC Number:
18806
Properties
Properties
 
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
319  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route
186581-53-3    29346-20-1   
5-isopropyl-2,3-dimethoxy-cycloheptatrienone 

[1]CanadianJournalofChemistry,1957,vol.35,p.1039,1046

[1]CanadianJournalofChemistry,1957,vol.35,p.1039,1046

[1]Sci.Rep.TohokuUniv.,Ser.1:Phys.,Chem.,Astron.,1956,vol.<I>40,p.121,123

[1]BulletinoftheChemicalSocietyofJapan,1991,vol.64,p.3306-3312

623-11-0    672-76-4   
K2S2O8 
  29346-20-1 

[1]CanadianJournalofChemistry,1957,vol.35,p.1039,1046

Literature

Title: Exploiting drug-resistant enzymes as tools to identify thienopyrimidinone inhibitors of human immunodeficiency virus reverse transcriptase-associated ribonuclease H.

Journal: Journal of medicinal chemistry 20130711

Title: Synthesis, activity, and structural analysis of novel α-hydroxytropolone inhibitors of human immunodeficiency virus reverse transcriptase-associated ribonuclease H.

Journal: Journal of medicinal chemistry 20110714

Title: Structure-activity analysis of vinylogous urea inhibitors of human immunodeficiency virus-encoded ribonuclease H.

Journal: Antimicrobial agents and chemotherapy 20100901

Title: Structure of HIV-1 reverse transcriptase with the inhibitor beta-Thujaplicinol bound at the RNase H active site.

Journal: Structure (London, England : 1993) 20091209

Title: Preferential inhibition of the magnesium-dependent strand transfer reaction of HIV-1 integrase by alpha-hydroxytropolones.

Journal: Molecular pharmacology 20060401

Title: Selective inhibition of HIV-1 reverse transcriptase-associated ribonuclease H activity by hydroxylated tropolones.

Journal: Nucleic acids research 20050101

Title: Thujaplicin-copper chelates inhibit replication of human influenza viruses.

Journal: Antiviral research 19980801

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SDS
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Tags:29346-20-1 Molecular Formula|29346-20-1 MDL|29346-20-1 SMILES|29346-20-1 2,4,6-Cycloheptatrien-1-one, 2,3-dihydroxy-5-(1-methylethyl)-