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Home Other Building Blocks 52613-28-2
52613-28-2,MFCD21364063
Catalog No.:AA00DHK6

52613-28-2 | Deacetyl asperulosidic acid methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10mg
98%
in stock  
$268.00   $188.00
- +
1g
98%
in stock  
$19,024.00   $13,317.00
- +
5g
98%
in stock  
$85,399.00   $59,779.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00DHK6
Chemical Name:
Deacetyl asperulosidic acid methyl ester
CAS Number:
52613-28-2
Molecular Formula:
C17H24O11
Molecular Weight:
404.3659
MDL Number:
MFCD21364063
SMILES:
OCC1=C[C@@H]([C@H]2[C@@H]1[C@@H](OC=C2C(=O)OC)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)O
Properties
Computed Properties
 
Complexity:
647  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
9  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
6  
Rotatable Bond Count:
6  
XLogP3:
-3.5  

Literature

Title: Immunosuppressive iridoids from the fruits of Gardenia jasminoides.

Journal: Journal of natural products 20051101

Title: Lucia Maria Conserva, et al. Borreria and Spermacoce species (Rubiaceae): A review of their ethnomedicinal properties, chemical constituents, and biological activities. Pharmacogn Rev. 2012 Jan;6(11):46-55.

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SDS
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Tags:52613-28-2 Molecular Formula|52613-28-2 MDL|52613-28-2 SMILES|52613-28-2 Deacetyl asperulosidic acid methyl ester