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70831-56-0,MFCD00189418
Catalog No.:AA019D39

70831-56-0 | L-Chicoric Acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$15.00   $11.00
- +
5mg
98%
in stock  
$37.00   $26.00
- +
10mg
98%
in stock  
$54.00   $38.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA019D39
Chemical Name:
L-Chicoric Acid
CAS Number:
70831-56-0
Molecular Formula:
C22H18O12
Molecular Weight:
474.3711
MDL Number:
MFCD00189418
SMILES:
O=C(OC(C(C(=O)O)OC(=O)C=Cc1ccc(c(c1)O)O)C(=O)O)C=Cc1ccc(c(c1)O)O
NSC Number:
699173
Properties
Properties
 
BP:
785°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
740  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
2  
Formal Charge:
0  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0  
Rotatable Bond Count:
11  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Downstream Synthesis Route

[1]Scarpati;Oriente[Tetrahedron,1958,vol.4,p.43,44,45]

[1]Tetrahedron,1958,vol.4,p.43,44,45

[1]Zhao,He;BurkeJr.,TerrenceR.[SyntheticCommunications,1998,vol.28,#4,p.737-740]

[1]Lamidey,Anne-Marie;Fernon,Lionel;Pouysegu,Laurent;Delattre,Charlotte;Quideau,Stephane;Pardon,Patrick[HelveticaChimicaActa,2002,vol.85,#8,p.2328-2334]

[1]Lamidey,Anne-Marie;Fernon,Lionel;Pouysegu,Laurent;Delattre,Charlotte;Quideau,Stephane;Pardon,Patrick[HelveticaChimicaActa,2002,vol.85,#8,p.2328-2334]

Literature

Title: Reinke RA, et al. L-chicoric acid inhibits human immunodeficiency virus type 1 integration in vivo and is a noncompetitive but reversible inhibitor of HIV-1 integrase in vitro. Virology. 2004 Sep 1;326(2):203-19.

Title: King PJ, et al. Resistance to the anti-human immunodeficiency virus type 1 compound L-chicoric acid results from a single mutation at amino acid 140 of integrase. J Virol. 1998 Oct;72(10):8420-4.

Title: Robinson WE Jr. L-chicoric acid, an inhibitor of human immunodeficiency virus type 1 (HIV-1) integrase, improves on the in vitro anti-HIV-1 effect of a protease inhibitor (AG1350). Antiviral Res. 1998 Aug;39(2):101-11.

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SDS
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Tags:70831-56-0 Molecular Formula|70831-56-0 MDL|70831-56-0 SMILES|70831-56-0 L-Chicoric Acid
Catalog No.: AA019D39
70831-56-0,MFCD00189418
70831-56-0 | L-Chicoric Acid
Pack Size： 1mg
Purity： 98%
in stock
$15.00 $11.00
Pack Size： 5mg
Purity： 98%
in stock
$37.00 $26.00
Pack Size： 10mg
Purity： 98%
in stock
$54.00 $38.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA019D39
Chemical Name: L-Chicoric Acid
CAS Number: 70831-56-0
Molecular Formula: C22H18O12
Molecular Weight: 474.3711
MDL Number: MFCD00189418
SMILES: O=C(OC(C(C(=O)O)OC(=O)C=Cc1ccc(c(c1)O)O)C(=O)O)C=Cc1ccc(c(c1)O)O
NSC Number: 699173
Properties
BP: 785°C at 760 mmHg  
Form: Solid  
Storage: Keep in dry area;2-8℃;  
Complexity: 740  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 2  
Formal Charge: 0  
Heavy Atom Count: 34  
Hydrogen Bond Acceptor Count: 12  
Hydrogen Bond Donor Count: 6  
Isotope Atom Count: 0  
Rotatable Bond Count: 11  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Downstream Synthesis Route
87-69-4    70831-56-0 

[1]Scarpati;Oriente[Tetrahedron,1958,vol.4,p.43,44,45]

6537-80-0    6537-80-0    6537-80-0 

[1]Tetrahedron,1958,vol.4,p.43,44,45

204273-55-2    70831-56-0 

[1]Zhao,He;BurkeJr.,TerrenceR.[SyntheticCommunications,1998,vol.28,#4,p.737-740]

488148-82-9    70831-56-0 

[1]Lamidey,Anne-Marie;Fernon,Lionel;Pouysegu,Laurent;Delattre,Charlotte;Quideau,Stephane;Pardon,Patrick[HelveticaChimicaActa,2002,vol.85,#8,p.2328-2334]

501-16-6    70831-56-0 

[1]Lamidey,Anne-Marie;Fernon,Lionel;Pouysegu,Laurent;Delattre,Charlotte;Quideau,Stephane;Pardon,Patrick[HelveticaChimicaActa,2002,vol.85,#8,p.2328-2334]

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